N-[(E)-(4-bromophenyl)methylideneamino]-1-(phenylmethyl)pyridin-1-ium-3-carboxamide chloride

Systemtic Name: N-[(E)-(4-bromophenyl)methylideneamino]-1-(phenylmethyl)pyridin-1-ium-3-carboxamide chloride Openeye Name: 1-benzyl-N-[(E)-(4-bromophenyl)methyleneamino]pyridin-1-ium-3-carboxamide chloride CAS Name: N-[(E)-(4-bromophenyl)methylideneamino]-1-(phenylmethyl)-3-pyridin-1-iumcarboxamide chloride IUPAC Name: 1-benzyl-N-[(E)-(4-bromophenyl)methylideneamino]pyridin-1-ium-3-carboxamide chloride Traditional Name: 1-benzyl-N-[(E)-(4-bromobenzylidene)amino]pyridin-1-ium-3-carboxamide chloride Formula: C20H17BrClN3O MolecularWeight: 430.72548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=CC=CC(=C2)C(=O)NN=CC3=CC=C(C=C3)Br.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=CC=CC(=C2)C(=O)N/N=C/C3=CC=C(C=C3)Br.[Cl-]

InChI

InChI=1S/C20H16BrN3O.ClH/c21-19-10-8-16(9-11-19)13-22-23-20(25)18-7-4-12-24(15-18)14-17-5-2-1-3-6-17;/h1-13,15H,14H2;1H/b22-13+;