N-[(2R)-2-(2-chlorophenyl)-2-(1H-indol-3-yl)ethyl]-1-oxidanidyl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-[(2R)-2-(2-chlorophenyl)-2-(1H-indol-3-yl)ethyl]-1-oxidanidyl-pyridin-1-ium-3-carboxamide Openeye Name: N-[(2R)-2-(2-chlorophenyl)-2-(1H-indol-3-yl)ethyl]-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: N-[(2R)-2-(2-chlorophenyl)-2-(1H-indol-3-yl)ethyl]-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: N-[(2R)-2-(2-chlorophenyl)-2-(1H-indol-3-yl)ethyl]-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: N-[(2R)-2-(2-chlorophenyl)-2-(1H-indol-3-yl)ethyl]-1-oxido-pyridin-1-ium-3-carboxamide Formula: C22H18ClN3O2 MolecularWeight: 391.85022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C(CNC(=O)C3=C[N+](=CC=C3)[O-])C4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)[C@@H](CNC(=O)C3=C[N+](=CC=C3)[O-])C4=CC=CC=C4Cl

InChI

InChI=1S/C22H18ClN3O2/c23-20-9-3-1-7-16(20)18(19-12-24-21-10-4-2-8-17(19)21)13-25-22(27)15-6-5-11-26(28)14-15/h1-12,14,18,24H,13H2,(H,25,27)/t18-/m0/s1