3-[6-bromanyl-1-[3-(diethylamino)-2-oxidanyl-propyl]indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione

Systemtic Name: 3-[6-bromanyl-1-[3-(diethylamino)-2-oxidanyl-propyl]indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione Openeye Name: 3-[6-bromo-1-[3-(diethylamino)-2-hydroxy-propyl]indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione CAS Name: 3-[6-bromo-1-[3-(diethylamino)-2-hydroxypropyl]-3-indolyl]-4-(1H-indol-3-yl)pyrrole-2,5-dione IUPAC Name: 3-[6-bromo-1-[3-(diethylamino)-2-hydroxypropyl]indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione Traditional Name: 3-[6-bromo-1-[3-(diethylamino)-2-hydroxy-propyl]indol-3-yl]-4-(1H-indol-3-yl)-3-pyrroline-2,5-quinone Formula: C27H27BrN4O3 MolecularWeight: 535.43228

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(CN1C=C(C2=C1C=C(C=C2)Br)C3=C(C(=O)NC3=O)C4=CNC5=CC=CC=C54)O

Isomeric SMILES

CCN(CC)CC(CN1C=C(C2=C1C=C(C=C2)Br)C3=C(C(=O)NC3=O)C4=CNC5=CC=CC=C54)O

InChI

InChI=1S/C27H27BrN4O3/c1-3-31(4-2)13-17(33)14-32-15-21(19-10-9-16(28)11-23(19)32)25-24(26(34)30-27(25)35)20-12-29-22-8-6-5-7-18(20)22/h5-12,15,17,29,33H,3-4,13-14H2,1-2H3,(H,30,34,35)