9-methyl-2-(2-methylpropyl)-4-piperidin-1-ylcarbonyl-pyrido[3,4-b]indol-1-one

Systemtic Name: 9-methyl-2-(2-methylpropyl)-4-piperidin-1-ylcarbonyl-pyrido[3,4-b]indol-1-one Openeye Name: 2-isobutyl-9-methyl-4-(piperidine-1-carbonyl)pyrido[3,4-b]indol-1-one CAS Name: 9-methyl-2-(2-methylpropyl)-4-[oxo(1-piperidinyl)methyl]-1-pyrido[3,4-b]indolone IUPAC Name: 9-methyl-2-(2-methylpropyl)-4-(piperidine-1-carbonyl)pyrido[3,4-b]indol-1-one Traditional Name: 2-isobutyl-9-methyl-4-(piperidine-1-carbonyl)-$b-carbolin-1-one Formula: C22H27N3O2 MolecularWeight: 365.46868

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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)N4CCCCC4

Isomeric SMILES

CC(C)CN1C=C(C2=C(C1=O)N(C3=CC=CC=C32)C)C(=O)N4CCCCC4

InChI

InChI=1S/C22H27N3O2/c1-15(2)13-25-14-17(21(26)24-11-7-4-8-12-24)19-16-9-5-6-10-18(16)23(3)20(19)22(25)27/h5-6,9-10,14-15H,4,7-8,11-13H2,1-3H3