4-cyclohexyl-7-nitro-6-[3-[[4-(phenylmethyl)piperazin-1-yl]methyl]pyrrol-1-yl]-1H-quinoxaline-2,3-dione

Systemtic Name: 4-cyclohexyl-7-nitro-6-[3-[[4-(phenylmethyl)piperazin-1-yl]methyl]pyrrol-1-yl]-1H-quinoxaline-2,3-dione Openeye Name: 6-[3-[(4-benzylpiperazin-1-yl)methyl]pyrrol-1-yl]-4-cyclohexyl-7-nitro-1H-quinoxaline-2,3-dione CAS Name: 4-cyclohexyl-7-nitro-6-[3-[[4-(phenylmethyl)-1-piperazinyl]methyl]-1-pyrrolyl]-1H-quinoxaline-2,3-dione IUPAC Name: 6-[3-[(4-benzylpiperazin-1-yl)methyl]pyrrol-1-yl]-4-cyclohexyl-7-nitro-1H-quinoxaline-2,3-dione Traditional Name: 6-[3-[(4-benzylpiperazino)methyl]pyrrol-1-yl]-4-cyclohexyl-7-nitro-1H-quinoxaline-2,3-quinone Formula: C30H34N6O4 MolecularWeight: 542.62876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=CC(=C(C=C3NC(=O)C2=O)[N+](=O)[O-])N4C=CC(=C4)CN5CCN(CC5)CC6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)N2C3=CC(=C(C=C3NC(=O)C2=O)[N+](=O)[O-])N4C=CC(=C4)CN5CCN(CC5)CC6=CC=CC=C6

InChI

InChI=1S/C30H34N6O4/c37-29-30(38)35(24-9-5-2-6-10-24)26-18-27(28(36(39)40)17-25(26)31-29)34-12-11-23(21-34)20-33-15-13-32(14-16-33)19-22-7-3-1-4-8-22/h1,3-4,7-8,11-12,17-18,21,24H,2,5-6,9-10,13-16,19-20H2,(H,31,37)