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

Systemtic Name: N-[(E)-(4-bromophenyl)methylideneamino]-1-(phenylmethyl)pyridin-1-ium-4-carboxamide chloride Openeye Name: 1-benzyl-N-[(E)-(4-bromophenyl)methyleneamino]pyridin-1-ium-4-carboxamide chloride CAS Name: N-[(E)-(4-bromophenyl)methylideneamino]-1-(phenylmethyl)-4-pyridin-1-iumcarboxamide chloride IUPAC Name: 1-benzyl-N-[(E)-(4-bromophenyl)methylideneamino]pyridin-1-ium-4-carboxamide chloride Traditional Name: 1-benzyl-N-[(E)-(4-bromobenzylidene)amino]pyridin-1-ium-4-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=C(C=C2)C(=O)NN=CC3=CC=C(C=C3)Br.[Cl-]

Isomeric SMILES

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

InChI

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