2,9-dimethyl-4-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-pyrido[3,4-b]indol-1-one

Systemtic Name: 2,9-dimethyl-4-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-pyrido[3,4-b]indol-1-one Openeye Name: 2,9-dimethyl-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]pyrido[3,4-b]indol-1-one CAS Name: 2,9-dimethyl-4-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]-1-pyrido[3,4-b]indolone IUPAC Name: 2,9-dimethyl-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]pyrido[3,4-b]indol-1-one Traditional Name: 2,9-dimethyl-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-$b-carbolin-1-one Formula: C24H23N5O4 MolecularWeight: 445.47052

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C(C1=O)N(C3=CC=CC=C32)C)C(=O)N4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C2=C(C1=O)N(C3=CC=CC=C32)C)C(=O)N4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C24H23N5O4/c1-25-15-19(21-18-5-3-4-6-20(18)26(2)22(21)24(25)31)23(30)28-13-11-27(12-14-28)16-7-9-17(10-8-16)29(32)33/h3-10,15H,11-14H2,1-2H3