7a-[[1-[3-(1H-indol-3-yl)propyl]pyrrolidin-3-yl]methyl]-4,5-dimethoxy-3aH-isoindole-1,3-dione

Systemtic Name: 7a-[[1-[3-(1H-indol-3-yl)propyl]pyrrolidin-3-yl]methyl]-4,5-dimethoxy-3aH-isoindole-1,3-dione Openeye Name: 7a-[[1-[3-(1H-indol-3-yl)propyl]pyrrolidin-3-yl]methyl]-4,5-dimethoxy-3aH-isoindole-1,3-dione CAS Name: 7a-[[1-[3-(1H-indol-3-yl)propyl]-3-pyrrolidinyl]methyl]-4,5-dimethoxy-3aH-isoindole-1,3-dione IUPAC Name: 7a-[[1-[3-(1H-indol-3-yl)propyl]pyrrolidin-3-yl]methyl]-4,5-dimethoxy-3aH-isoindole-1,3-dione Traditional Name: 7a-[[1-[3-(1H-indol-3-yl)propyl]pyrrolidin-3-yl]methyl]-4,5-dimethoxy-3aH-isoindole-1,3-quinone Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2C(=O)NC(=O)C2(C=C1)CC3CCN(C3)CCCC4=CNC5=CC=CC=C54)OC

Isomeric SMILES

COC1=C(C2C(=O)NC(=O)C2(C=C1)CC3CCN(C3)CCCC4=CNC5=CC=CC=C54)OC

InChI

InChI=1S/C26H31N3O4/c1-32-21-9-11-26(22(23(21)33-2)24(30)28-25(26)31)14-17-10-13-29(16-17)12-5-6-18-15-27-20-8-4-3-7-19(18)20/h3-4,7-9,11,15,17,22,27H,5-6,10,12-14,16H2,1-2H3,(H,28,30,31)