6-(2-azanylidene-1-cyano-ethenyl)-3-(2-methylpyridin-1-ium-1-yl)-4-(4-nitrophenyl)-2-oxidanyl-2-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile

Systemtic Name: 6-(2-azanylidene-1-cyano-ethenyl)-3-(2-methylpyridin-1-ium-1-yl)-4-(4-nitrophenyl)-2-oxidanyl-2-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile Openeye Name: 6-(1-cyano-2-imino-vinyl)-2-hydroxy-3-(2-methylpyridin-1-ium-1-yl)-4-(4-nitrophenyl)-2-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile CAS Name: 6-(1-cyano-2-iminoethenyl)-2-hydroxy-3-(2-methyl-1-pyridin-1-iumyl)-4-(4-nitrophenyl)-2-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile IUPAC Name: 6-(1-cyano-2-iminoethenyl)-2-hydroxy-3-(2-methylpyridin-1-ium-1-yl)-4-(4-nitrophenyl)-2-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile Traditional Name: 6-(1-cyano-2-imino-vinyl)-2-hydroxy-3-(2-methylpyridin-1-ium-1-yl)-4-(4-nitrophenyl)-2-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile Formula: C27H21N6O3+ MolecularWeight: 477.49404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=[N+]1C2C(C(=C(NC2(C3=CC=CC=C3)O)C(=C=N)C#N)C#N)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=[N+]1C2C(C(=C(NC2(C3=CC=CC=C3)O)C(=C=N)C#N)C#N)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H21N6O3/c1-18-7-5-6-14-32(18)26-24(19-10-12-22(13-11-19)33(35)36)23(17-30)25(20(15-28)16-29)31-27(26,34)21-8-3-2-4-9-21/h2-14,24,26,28,31,34H,1H3/q+1