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

Systemtic Name: 3-(5-nitro-1H-indol-3-yl)-4-[5-nitro-1-(3-piperidin-1-ylpropyl)indol-3-yl]pyrrole-2,5-dione Openeye Name: 3-(5-nitro-1H-indol-3-yl)-4-[5-nitro-1-[3-(1-piperidyl)propyl]indol-3-yl]pyrrole-2,5-dione CAS Name: 3-(5-nitro-1H-indol-3-yl)-4-[5-nitro-1-[3-(1-piperidinyl)propyl]-3-indolyl]pyrrole-2,5-dione IUPAC Name: 3-(5-nitro-1H-indol-3-yl)-4-[5-nitro-1-(3-piperidin-1-ylpropyl)indol-3-yl]pyrrole-2,5-dione Traditional Name: 3-(5-nitro-1H-indol-3-yl)-4-[5-nitro-1-(3-piperidinopropyl)indol-3-yl]-3-pyrroline-2,5-quinone Formula: C28H26N6O6 MolecularWeight: 542.54264

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCN2C=C(C3=C2C=CC(=C3)[N+](=O)[O-])C4=C(C(=O)NC4=O)C5=CNC6=C5C=C(C=C6)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CCCN2C=C(C3=C2C=CC(=C3)[N+](=O)[O-])C4=C(C(=O)NC4=O)C5=CNC6=C5C=C(C=C6)[N+](=O)[O-]

InChI

InChI=1S/C28H26N6O6/c35-27-25(21-15-29-23-7-5-17(33(37)38)13-19(21)23)26(28(36)30-27)22-16-32(12-4-11-31-9-2-1-3-10-31)24-8-6-18(34(39)40)14-20(22)24/h5-8,13-16,29H,1-4,9-12H2,(H,30,35,36)