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

Systemtic Name: 3-(1H-indol-3-yl)-4-[5-oxidanyl-1-(3-piperidin-1-ylpropyl)indol-3-yl]pyrrole-2,5-dione Openeye Name: 3-[5-hydroxy-1-[3-(1-piperidyl)propyl]indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione CAS Name: 3-[5-hydroxy-1-[3-(1-piperidinyl)propyl]-3-indolyl]-4-(1H-indol-3-yl)pyrrole-2,5-dione IUPAC Name: 3-[5-hydroxy-1-(3-piperidin-1-ylpropyl)indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione Traditional Name: 3-[5-hydroxy-1-(3-piperidinopropyl)indol-3-yl]-4-(1H-indol-3-yl)-3-pyrroline-2,5-quinone Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCN2C=C(C3=C2C=CC(=C3)O)C4=C(C(=O)NC4=O)C5=CNC6=CC=CC=C65

Isomeric SMILES

C1CCN(CC1)CCCN2C=C(C3=C2C=CC(=C3)O)C4=C(C(=O)NC4=O)C5=CNC6=CC=CC=C65

InChI

InChI=1S/C28H28N4O3/c33-18-9-10-24-20(15-18)22(17-32(24)14-6-13-31-11-4-1-5-12-31)26-25(27(34)30-28(26)35)21-16-29-23-8-3-2-7-19(21)23/h2-3,7-10,15-17,29,33H,1,4-6,11-14H2,(H,30,34,35)