Identitet

Etomidate N-Oxide

CAS 2433776-55-5 · C14H16N2O3

01Identitet

Lazychem IDLC-14743
CAS RN2433776-55-5
PubChem CID168444914
Molecular formulaC14H16N2O3
Molecular weight260.29 g/mol
IUPAC name(R)-5-(ethoxycarbonyl)-1-(1-phenylethyl)-1H-imidazole 3-oxide
InChIKeyRPDYKYAQGAJLKM-LLVKDONJSA-N

02Struktur og stereokemi

2D structurePubChem CID 168444914
Two-dimensional chemical structure of Etomidate N-Oxide, CAS 2433776-55-5
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 2 rings, includes aromatic atoms, includes aliphatic carbon, has 1 defined stereocentre. These statements are calculated from the published structure string.

Defined stereocentres1
Ring count2
Secondary amines0
Tertiary amines0
SMILESCCOC(=O)C1=C[N+](=CN1[C@H](C)C2=CC=CC=C2)[O-]
InChIIkke angivet

03Stereochemistry

The published structure contains 1 defined and 0 unassigned tetrahedral stereocentre. The exact wedge and dash depiction is shown above.

Defined centres1Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 2Before symmetry reduction

Published same-connectivity configurations

1 record

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.

No additional structure-linked configuration with the same connectivity is currently present in the LazyChem dataset.

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04Status i Indien

Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.

05Navne og relationer

API og moderlægemiddel

Etomidate

Urenheder og beslægtede forbindelser

Navne og relationer

  • Etomidate Impurity 7/ Etomidate N-Oxide
  • Etomidate Impurity 7
  • Etomidate N-Oxide
  • 1H-Imidazole-5-carboxylic acid, 1-[(1R)-1-phenylethyl]-, ethyl ester, 3-oxide
  • ethyl 1-oxido-3-[(1R)-1-phenylethyl]imidazol-1-ium-4-carboxylate
  • 2433776-55-5
  • (R)-5-(Ethoxycarbonyl)-1-(1-phenylethyl)-1H-imidazole 3-oxide
  • Etomidate Impurity N15

Urenheder og beslægtede forbindelser

06Kilder