N-[1-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-4-yl]benzamide bromide

Systemtic Name: N-[1-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-4-yl]benzamide bromide Openeye Name: N-[1-[2-(4-chlorophenyl)-2-oxo-ethyl]pyridin-1-ium-4-yl]benzamide bromide CAS Name: N-[1-[2-(4-chlorophenyl)-2-oxoethyl]-4-pyridin-1-iumyl]benzamide bromide IUPAC Name: N-[1-[2-(4-chlorophenyl)-2-oxoethyl]pyridin-1-ium-4-yl]benzamide bromide Traditional Name: N-[1-[2-(4-chlorophenyl)-2-keto-ethyl]pyridin-1-ium-4-yl]benzamide bromide Formula: C20H16BrClN2O2 MolecularWeight: 431.71024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC=[N+](C=C2)CC(=O)C3=CC=C(C=C3)Cl.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=[N+](C=C2)CC(=O)C3=CC=C(C=C3)Cl.[Br-]

InChI

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