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

Systemtic Name: 4-[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl-9-methyl-2-(2-methylpropyl)pyrido[3,4-b]indol-1-one Openeye Name: 2-isobutyl-4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-9-methyl-pyrido[3,4-b]indol-1-one CAS Name: 4-[[4-(2-methoxyphenyl)-1-piperazinyl]-oxomethyl]-9-methyl-2-(2-methylpropyl)-1-pyrido[3,4-b]indolone IUPAC Name: 4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-9-methyl-2-(2-methylpropyl)pyrido[3,4-b]indol-1-one Traditional Name: 2-isobutyl-4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-9-methyl-$b-carbolin-1-one Formula: C28H32N4O3 MolecularWeight: 472.57868

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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)C5=CC=CC=C5OC

Isomeric SMILES

CC(C)CN1C=C(C2=C(C1=O)N(C3=CC=CC=C32)C)C(=O)N4CCN(CC4)C5=CC=CC=C5OC

InChI

InChI=1S/C28H32N4O3/c1-19(2)17-32-18-21(25-20-9-5-6-10-22(20)29(3)26(25)28(32)34)27(33)31-15-13-30(14-16-31)23-11-7-8-12-24(23)35-4/h5-12,18-19H,13-17H2,1-4H3