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

Systemtic Name: 6-(2-azanylidene-1-cyano-ethenyl)-4-(4-bromophenyl)-2-cyclopropyl-3-(4-methylpyridin-1-ium-1-yl)-2-oxidanyl-3,4-dihydro-1H-pyridine-5-carbonitrile Openeye Name: 4-(4-bromophenyl)-6-(1-cyano-2-imino-vinyl)-2-cyclopropyl-2-hydroxy-3-(4-methylpyridin-1-ium-1-yl)-3,4-dihydro-1H-pyridine-5-carbonitrile CAS Name: 4-(4-bromophenyl)-6-(1-cyano-2-iminoethenyl)-2-cyclopropyl-2-hydroxy-3-(4-methyl-1-pyridin-1-iumyl)-3,4-dihydro-1H-pyridine-5-carbonitrile IUPAC Name: 4-(4-bromophenyl)-6-(1-cyano-2-iminoethenyl)-2-cyclopropyl-2-hydroxy-3-(4-methylpyridin-1-ium-1-yl)-3,4-dihydro-1H-pyridine-5-carbonitrile Traditional Name: 4-(4-bromophenyl)-6-(1-cyano-2-imino-vinyl)-2-cyclopropyl-2-hydroxy-3-(4-methylpyridin-1-ium-1-yl)-3,4-dihydro-1H-pyridine-5-carbonitrile Formula: C24H21BrN5O+ MolecularWeight: 475.36044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C=C1)C2C(C(=C(NC2(C3CC3)O)C(=C=N)C#N)C#N)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=[N+](C=C1)C2C(C(=C(NC2(C3CC3)O)C(=C=N)C#N)C#N)C4=CC=C(C=C4)Br

InChI

InChI=1S/C24H21BrN5O/c1-15-8-10-30(11-9-15)23-21(16-2-6-19(25)7-3-16)20(14-28)22(17(12-26)13-27)29-24(23,31)18-4-5-18/h2-3,6-11,18,21,23,26,29,31H,4-5H2,1H3/q+1