5,11-dimethyl-2-(phenylcarbonyl)-1,6-bis(phenylmethyl)pyrido[4,3-b]carbazole-1-carbonitrile

Systemtic Name: 5,11-dimethyl-2-(phenylcarbonyl)-1,6-bis(phenylmethyl)pyrido[4,3-b]carbazole-1-carbonitrile Openeye Name: 2-benzoyl-1,6-dibenzyl-5,11-dimethyl-pyrido[4,3-b]carbazole-1-carbonitrile CAS Name: 2-benzoyl-5,11-dimethyl-1,6-bis(phenylmethyl)-1-pyrido[4,3-b]carbazolecarbonitrile IUPAC Name: 2-benzoyl-1,6-dibenzyl-5,11-dimethylpyrido[4,3-b]carbazole-1-carbonitrile Traditional Name: 2-benzoyl-1,6-dibenzyl-5,11-dimethyl-pyrido[4,3-b]carbazole-1-carbonitrile Formula: C39H31N3O MolecularWeight: 557.68294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C3=C1C=CN(C3(CC4=CC=CC=C4)C#N)C(=O)C5=CC=CC=C5)C)C6=CC=CC=C6N2CC7=CC=CC=C7

Isomeric SMILES

CC1=C2C(=C(C3=C1C=CN(C3(CC4=CC=CC=C4)C#N)C(=O)C5=CC=CC=C5)C)C6=CC=CC=C6N2CC7=CC=CC=C7

InChI

InChI=1S/C39H31N3O/c1-27-32-22-23-42(38(43)31-18-10-5-11-19-31)39(26-40,24-29-14-6-3-7-15-29)36(32)28(2)35-33-20-12-13-21-34(33)41(37(27)35)25-30-16-8-4-9-17-30/h3-23H,24-25H2,1-2H3