3-[[4-[(Z)-2-(2-methylphenyl)ethenyl]pyridin-1-ium-1-yl]methyl]benzoate

Systemtic Name: 3-[[4-[(Z)-2-(2-methylphenyl)ethenyl]pyridin-1-ium-1-yl]methyl]benzoate Openeye Name: 3-[[4-[(Z)-2-(o-tolyl)vinyl]pyridin-1-ium-1-yl]methyl]benzoate CAS Name: 3-[[4-[(Z)-2-(2-methylphenyl)ethenyl]-1-pyridin-1-iumyl]methyl]benzoate IUPAC Name: 3-[[4-[(Z)-2-(2-methylphenyl)ethenyl]pyridin-1-ium-1-yl]methyl]benzoate Traditional Name: 3-[[4-[(Z)-2-(o-tolyl)vinyl]pyridin-1-ium-1-yl]methyl]benzoate Formula: C22H19NO2 MolecularWeight: 329.39176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=CC2=CC=[N+](C=C2)CC3=CC=CC(=C3)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1/C=C\C2=CC=[N+](C=C2)CC3=CC=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C22H19NO2/c1-17-5-2-3-7-20(17)10-9-18-11-13-23(14-12-18)16-19-6-4-8-21(15-19)22(24)25/h2-15H,16H2,1H3/b10-9-