1-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]-N-phenyl-pyridin-1-ium-3-carboxamide bromide

Systemtic Name: 1-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]-N-phenyl-pyridin-1-ium-3-carboxamide bromide Openeye Name: 1-[2-(4-chlorophenyl)-2-oxo-ethyl]-N-phenyl-pyridin-1-ium-3-carboxamide bromide CAS Name: 1-[2-(4-chlorophenyl)-2-oxoethyl]-N-phenyl-3-pyridin-1-iumcarboxamide bromide IUPAC Name: 1-[2-(4-chlorophenyl)-2-oxoethyl]-N-phenylpyridin-1-ium-3-carboxamide bromide Traditional Name: 1-[2-(4-chlorophenyl)-2-keto-ethyl]-N-phenyl-pyridin-1-ium-3-carboxamide bromide Formula: C20H16BrClN2O2 MolecularWeight: 431.71024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15ClN2O2.BrH/c21-17-10-8-15(9-11-17)19(24)14-23-12-4-5-16(13-23)20(25)22-18-6-2-1-3-7-18;/h1-13H,14H2;1H