3-(5-nitro-1H-indol-3-yl)-4-[5-nitro-1-(2-oxidanyl-3-piperidin-1-yl-propyl)indol-3-yl]pyrrole-2,5-dione

Systemtic Name: 3-(5-nitro-1H-indol-3-yl)-4-[5-nitro-1-(2-oxidanyl-3-piperidin-1-yl-propyl)indol-3-yl]pyrrole-2,5-dione Openeye Name: 3-[1-[2-hydroxy-3-(1-piperidyl)propyl]-5-nitro-indol-3-yl]-4-(5-nitro-1H-indol-3-yl)pyrrole-2,5-dione CAS Name: 3-[1-[2-hydroxy-3-(1-piperidinyl)propyl]-5-nitro-3-indolyl]-4-(5-nitro-1H-indol-3-yl)pyrrole-2,5-dione IUPAC Name: 3-[1-(2-hydroxy-3-piperidin-1-ylpropyl)-5-nitroindol-3-yl]-4-(5-nitro-1H-indol-3-yl)pyrrole-2,5-dione Traditional Name: 3-[1-(2-hydroxy-3-piperidino-propyl)-5-nitro-indol-3-yl]-4-(5-nitro-1H-indol-3-yl)-3-pyrroline-2,5-quinone Formula: C28H26N6O7 MolecularWeight: 558.54204

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(CN2C=C(C3=C2C=CC(=C3)[N+](=O)[O-])C4=C(C(=O)NC4=O)C5=CNC6=C5C=C(C=C6)[N+](=O)[O-])O

Isomeric SMILES

C1CCN(CC1)CC(CN2C=C(C3=C2C=CC(=C3)[N+](=O)[O-])C4=C(C(=O)NC4=O)C5=CNC6=C5C=C(C=C6)[N+](=O)[O-])O

InChI

InChI=1S/C28H26N6O7/c35-18(13-31-8-2-1-3-9-31)14-32-15-22(20-11-17(34(40)41)5-7-24(20)32)26-25(27(36)30-28(26)37)21-12-29-23-6-4-16(33(38)39)10-19(21)23/h4-7,10-12,15,18,29,35H,1-3,8-9,13-14H2,(H,30,36,37)