Identita

Mefloquine

Neuvedeno · C17H16F6N2O

01Identita

Lazychem IDLC-54570
CAS RNNeuvedeno
PubChem CID4046
Molecular formulaC17H16F6N2O
Molecular weight378.31 g/mol
IUPAC name[2,8-bis(trifluoromethyl)quinolin-4-yl]-piperidin-2-ylmethanol
InChIKeyXEEQGYMUWCZPDN-UHFFFAOYSA-N

02Struktura a stereochemie

2D structurePubChem CID 4046
Two-dimensional chemical structure of Mefloquine
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 3 rings, includes aromatic atoms, includes aliphatic carbon, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres0
Ring count3
Secondary amines1
Tertiary amines0
SMILESC1CCNC(C1)C(C2=CC(=NC3=C2C=CC=C3C(F)(F)F)C(F)(F)F)O
InChINeuvedeno

03Stereochemistry

The published structure contains 0 defined and 2 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres0Structure assigned
Unassigned centres2Structure unspecified
Assignment statusUnassignedExact published identity
Tetrahedral upper bound≤ 4Before symmetry reduction

Published same-connectivity configurations

3 records

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.

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.

04Stav v Indii

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

05Názvy a vztahy

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      06Zdroje