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

Systemtic Name: 3-[6-bromanyl-1-(2-oxidanyl-3-piperidin-1-yl-propyl)indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione Openeye Name: 3-[6-bromo-1-[2-hydroxy-3-(1-piperidyl)propyl]indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione CAS Name: 3-[6-bromo-1-[2-hydroxy-3-(1-piperidinyl)propyl]-3-indolyl]-4-(1H-indol-3-yl)pyrrole-2,5-dione IUPAC Name: 3-[6-bromo-1-(2-hydroxy-3-piperidin-1-ylpropyl)indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione Traditional Name: 3-[6-bromo-1-(2-hydroxy-3-piperidino-propyl)indol-3-yl]-4-(1H-indol-3-yl)-3-pyrroline-2,5-quinone Formula: C28H27BrN4O3 MolecularWeight: 547.44298

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(CN2C=C(C3=C2C=C(C=C3)Br)C4=C(C(=O)NC4=O)C5=CNC6=CC=CC=C65)O

Isomeric SMILES

C1CCN(CC1)CC(CN2C=C(C3=C2C=C(C=C3)Br)C4=C(C(=O)NC4=O)C5=CNC6=CC=CC=C65)O

InChI

InChI=1S/C28H27BrN4O3/c29-17-8-9-20-22(16-33(24(20)12-17)15-18(34)14-32-10-4-1-5-11-32)26-25(27(35)31-28(26)36)21-13-30-23-7-3-2-6-19(21)23/h2-3,6-9,12-13,16,18,30,34H,1,4-5,10-11,14-15H2,(H,31,35,36)