2,6-bis[(Z)-[3-(4-dimethylaminophenyl)-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]quinoline-4-carbonitrile

Systemtic Name: 2,6-bis[(Z)-[3-(4-dimethylaminophenyl)-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]quinoline-4-carbonitrile Openeye Name: 2,6-bis[(Z)-[3-(4-dimethylaminophenyl)-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]quinoline-4-carbonitrile CAS Name: 2,6-bis[(Z)-[3-(4-dimethylaminophenyl)-5,5-dimethyl-1-cyclohex-2-enylidene]methyl]-4-quinolinecarbonitrile IUPAC Name: 2,6-bis[(Z)-[3-(4-dimethylaminophenyl)-5,5-dimethylcyclohex-2-en-1-ylidene]methyl]quinoline-4-carbonitrile Traditional Name: 2,6-bis[(Z)-[3-(4-dimethylaminophenyl)-5,5-dimethyl-cyclohex-2-en-1-ylidene]methyl]cinchoninonitrile Formula: C44H48N4 MolecularWeight: 632.87872

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=CC2=CC3=C(C=C2)N=C(C=C3C#N)C=C4CC(CC(=C4)C5=CC=C(C=C5)N(C)C)(C)C)C1)C6=CC=C(C=C6)N(C)C)C

Isomeric SMILES

CC1(CC(=C/C(=C\C2=CC3=C(C=C2)N=C(C=C3C#N)/C=C\4/CC(CC(=C4)C5=CC=C(C=C5)N(C)C)(C)C)/C1)C6=CC=C(C=C6)N(C)C)C

InChI

InChI=1S/C44H48N4/c1-43(2)25-31(20-35(27-43)33-10-14-39(15-11-33)47(5)6)19-30-9-18-42-41(23-30)37(29-45)24-38(46-42)22-32-21-36(28-44(3,4)26-32)34-12-16-40(17-13-34)48(7)8/h9-24H,25-28H2,1-8H3/b31-19+,32-22+