4-[(E)-2-(3-nitrophenyl)ethenyl]-1-(phenylmethyl)pyridin-1-ium bromide

Systemtic Name: 4-[(E)-2-(3-nitrophenyl)ethenyl]-1-(phenylmethyl)pyridin-1-ium bromide Openeye Name: 1-benzyl-4-[(E)-2-(3-nitrophenyl)vinyl]pyridin-1-ium bromide CAS Name: 4-[(E)-2-(3-nitrophenyl)ethenyl]-1-(phenylmethyl)pyridin-1-ium bromide IUPAC Name: 1-benzyl-4-[(E)-2-(3-nitrophenyl)ethenyl]pyridin-1-ium bromide Traditional Name: 1-benzyl-4-[(E)-2-(3-nitrophenyl)vinyl]pyridin-1-ium bromide Formula: C20H17BrN2O2 MolecularWeight: 397.26518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17N2O2.BrH/c23-22(24)20-8-4-7-18(15-20)10-9-17-11-13-21(14-12-17)16-19-5-2-1-3-6-19;/h1-15H,16H2;1H/q+1;/p-1/b10-9+;