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

Systemtic Name: 6-(2-azanylidene-1-cyano-ethenyl)-2-cyclopropyl-4-(4-ethoxyphenyl)-3-(4-methylpyridin-1-ium-1-yl)-2-oxidanyl-3,4-dihydro-1H-pyridine-5-carbonitrile Openeye Name: 6-(1-cyano-2-imino-vinyl)-2-cyclopropyl-4-(4-ethoxyphenyl)-2-hydroxy-3-(4-methylpyridin-1-ium-1-yl)-3,4-dihydro-1H-pyridine-5-carbonitrile CAS Name: 6-(1-cyano-2-iminoethenyl)-2-cyclopropyl-4-(4-ethoxyphenyl)-2-hydroxy-3-(4-methyl-1-pyridin-1-iumyl)-3,4-dihydro-1H-pyridine-5-carbonitrile IUPAC Name: 6-(1-cyano-2-iminoethenyl)-2-cyclopropyl-4-(4-ethoxyphenyl)-2-hydroxy-3-(4-methylpyridin-1-ium-1-yl)-3,4-dihydro-1H-pyridine-5-carbonitrile Traditional Name: 6-(1-cyano-2-imino-vinyl)-2-cyclopropyl-2-hydroxy-3-(4-methylpyridin-1-ium-1-yl)-4-p-phenetyl-3,4-dihydro-1H-pyridine-5-carbonitrile Formula: C26H26N5O2+ MolecularWeight: 440.51694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2C(C(NC(=C2C#N)C(=C=N)C#N)(C3CC3)O)[N+]4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2C(C(NC(=C2C#N)C(=C=N)C#N)(C3CC3)O)[N+]4=CC=C(C=C4)C

InChI

InChI=1S/C26H26N5O2/c1-3-33-21-8-4-18(5-9-21)23-22(16-29)24(19(14-27)15-28)30-26(32,20-6-7-20)25(23)31-12-10-17(2)11-13-31/h4-5,8-13,20,23,25,27,30,32H,3,6-7H2,1-2H3/q+1