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

Systemtic Name: 3-[1-[3-(diethylamino)-2-oxidanyl-propyl]-5-nitro-indol-3-yl]-4-(5-nitro-1H-indol-3-yl)pyrrole-2,5-dione Openeye Name: 3-[1-[3-(diethylamino)-2-hydroxy-propyl]-5-nitro-indol-3-yl]-4-(5-nitro-1H-indol-3-yl)pyrrole-2,5-dione CAS Name: 3-[1-[3-(diethylamino)-2-hydroxypropyl]-5-nitro-3-indolyl]-4-(5-nitro-1H-indol-3-yl)pyrrole-2,5-dione IUPAC Name: 3-[1-[3-(diethylamino)-2-hydroxypropyl]-5-nitroindol-3-yl]-4-(5-nitro-1H-indol-3-yl)pyrrole-2,5-dione Traditional Name: 3-[1-[3-(diethylamino)-2-hydroxy-propyl]-5-nitro-indol-3-yl]-4-(5-nitro-1H-indol-3-yl)-3-pyrroline-2,5-quinone Formula: C27H26N6O7 MolecularWeight: 546.53134

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(CN1C=C(C2=C1C=CC(=C2)[N+](=O)[O-])C3=C(C(=O)NC3=O)C4=CNC5=C4C=C(C=C5)[N+](=O)[O-])O

Isomeric SMILES

CCN(CC)CC(CN1C=C(C2=C1C=CC(=C2)[N+](=O)[O-])C3=C(C(=O)NC3=O)C4=CNC5=C4C=C(C=C5)[N+](=O)[O-])O

InChI

InChI=1S/C27H26N6O7/c1-3-30(4-2)12-17(34)13-31-14-21(19-10-16(33(39)40)6-8-23(19)31)25-24(26(35)29-27(25)36)20-11-28-22-7-5-15(32(37)38)9-18(20)22/h5-11,14,17,28,34H,3-4,12-13H2,1-2H3,(H,29,35,36)