2-[[(1R)-2-[(2S)-2-(5-methoxy-1H-indol-3-yl)-2-oxidanyl-ethyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[(1R)-2-[(2S)-2-(5-methoxy-1H-indol-3-yl)-2-oxidanyl-ethyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[(1R)-2-[(2S)-2-hydroxy-2-(5-methoxy-1H-indol-3-yl)ethyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[(1R)-2-[(2S)-2-hydroxy-2-(5-methoxy-1H-indol-3-yl)ethyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[(1R)-2-[(2S)-2-hydroxy-2-(5-methoxy-1H-indol-3-yl)ethyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[(1R)-2-[(2S)-2-hydroxy-2-(5-methoxy-1H-indol-3-yl)ethyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindoline-1,3-quinone Formula: C29H27N3O4 MolecularWeight: 481.54238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC=C2C(CN3CCC4=CC=CC=C4C3CN5C(=O)C6=CC=CC=C6C5=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)NC=C2[C@@H](CN3CCC4=CC=CC=C4[C@@H]3CN5C(=O)C6=CC=CC=C6C5=O)O

InChI

InChI=1S/C29H27N3O4/c1-36-19-10-11-25-23(14-19)24(15-30-25)27(33)17-31-13-12-18-6-2-3-7-20(18)26(31)16-32-28(34)21-8-4-5-9-22(21)29(32)35/h2-11,14-15,26-27,30,33H,12-13,16-17H2,1H3/t26-,27+/m0/s1