Identité

Bethanechol-D9

Non indiqué · C7H8D9ClN2O2

01Identité

Lazychem IDLC-08172
CAS RNNon indiqué
PubChem CID71313960
Molecular formulaC7H8D9ClN2O2
Molecular weight205.73 g/mol
IUPAC name2-(carbamoyloxy)-N,N,N-tris(methyl-d3)propan-1-aminium chloride
InChIKeyNZUPCNDJBJXXRF-WVZRYRIDSA-O

02Structure et stéréochimie

2D structurePubChem CID 71313960
Two-dimensional chemical structure of Bethanechol-D9
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure is acyclic, includes aliphatic carbon. These statements are calculated from the published structure string.

Defined stereocentres0
Ring count0
Secondary amines0
Tertiary amines0
SMILESO=C(N)OC(C)C[N+](C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H]
InChINon indiqué

03Stereochemistry

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

Defined centres0Structure assigned
Unassigned centres1Structure unspecified
Assignment statusUnassignedExact 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.

04Statut en Inde

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

05Noms et relations

API et médicament parent

Bethanechol

Impuretés et composés apparentés

Noms et relations

    Impuretés et composés apparentés

    06Sources