4-(4-cyclohexylpiperazin-1-yl)carbonyl-9-methyl-2-(2-methylpropyl)pyrido[3,4-b]indol-1-one

Systemtic Name: 4-(4-cyclohexylpiperazin-1-yl)carbonyl-9-methyl-2-(2-methylpropyl)pyrido[3,4-b]indol-1-one Openeye Name: 4-(4-cyclohexylpiperazine-1-carbonyl)-2-isobutyl-9-methyl-pyrido[3,4-b]indol-1-one CAS Name: 4-[(4-cyclohexyl-1-piperazinyl)-oxomethyl]-9-methyl-2-(2-methylpropyl)-1-pyrido[3,4-b]indolone IUPAC Name: 4-(4-cyclohexylpiperazine-1-carbonyl)-9-methyl-2-(2-methylpropyl)pyrido[3,4-b]indol-1-one Traditional Name: 4-(4-cyclohexylpiperazine-1-carbonyl)-2-isobutyl-9-methyl-$b-carbolin-1-one Formula: C27H36N4O2 MolecularWeight: 448.60034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C2=C(C1=O)N(C3=CC=CC=C32)C)C(=O)N4CCN(CC4)C5CCCCC5

Isomeric SMILES

CC(C)CN1C=C(C2=C(C1=O)N(C3=CC=CC=C32)C)C(=O)N4CCN(CC4)C5CCCCC5

InChI

InChI=1S/C27H36N4O2/c1-19(2)17-31-18-22(24-21-11-7-8-12-23(21)28(3)25(24)27(31)33)26(32)30-15-13-29(14-16-30)20-9-5-4-6-10-20/h7-8,11-12,18-20H,4-6,9-10,13-17H2,1-3H3