Identitate

Amitifadine

Nu este indicat · C11H11Cl2N

01Identitate

Lazychem IDLC-76780
CAS RNNu este indicat
PubChem CID11658655
Molecular formulaC11H11Cl2N
Molecular weight228.11 g/mol
IUPAC name(1R,5S)-1-(3,4-dichlorophenyl)-3-azabicyclo[3.1.0]hexane
InChIKeyBSMNRYCSBFHEMQ-KCJUWKMLSA-N

02Structură și stereochimie

2D structurePubChem CID 11658655
Two-dimensional chemical structure of Amitifadine
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, has 2 defined stereocentres, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres2
Ring count3
Secondary amines1
Tertiary amines0
SMILESC1[C@H]2[C@@]1(CNC2)C3=CC(=C(C=C3)Cl)Cl
InChINu este indicat

03Stereochemistry

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

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

Published same-connectivity configurations

2 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.

04Statut în India

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

05Denumiri și relații

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