1-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]pyridin-1-ium-3-carboxamide bromide

Systemtic Name: 1-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]pyridin-1-ium-3-carboxamide bromide Openeye Name: 1-[2-oxo-2-(4-phenylphenyl)ethyl]pyridin-1-ium-3-carboxamide bromide CAS Name: 1-[2-oxo-2-(4-phenylphenyl)ethyl]-3-pyridin-1-iumcarboxamide bromide IUPAC Name: 1-[2-oxo-2-(4-phenylphenyl)ethyl]pyridin-1-ium-3-carboxamide bromide Traditional Name: 1-[2-keto-2-(4-phenylphenyl)ethyl]pyridin-1-ium-3-carboxamide bromide Formula: C20H17BrN2O2 MolecularWeight: 397.26518

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C[N+]3=CC=CC(=C3)C(=O)N.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C[N+]3=CC=CC(=C3)C(=O)N.[Br-]

InChI

InChI=1S/C20H16N2O2.BrH/c21-20(24)18-7-4-12-22(13-18)14-19(23)17-10-8-16(9-11-17)15-5-2-1-3-6-15;/h1-13H,14H2,(H-,21,24);1H