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

Systemtic Name: 3-[4-bromanyl-1-[3-(diethylamino)-2-oxidanyl-propyl]indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione Openeye Name: 3-[4-bromo-1-[3-(diethylamino)-2-hydroxy-propyl]indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione CAS Name: 3-[4-bromo-1-[3-(diethylamino)-2-hydroxypropyl]-3-indolyl]-4-(1H-indol-3-yl)pyrrole-2,5-dione IUPAC Name: 3-[4-bromo-1-[3-(diethylamino)-2-hydroxypropyl]indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione Traditional Name: 3-[4-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=CC=C2Br)C3=C(C(=O)NC3=O)C4=CNC5=CC=CC=C54)O

Isomeric SMILES

CCN(CC)CC(CN1C=C(C2=C1C=CC=C2Br)C3=C(C(=O)NC3=O)C4=CNC5=CC=CC=C54)O

InChI

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