(3R)-2-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-indol-3-yl)-3H-isoindol-1-one

Systemtic Name: (3R)-2-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-indol-3-yl)-3H-isoindol-1-one Openeye Name: (3R)-2-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-indol-3-yl)isoindolin-1-one CAS Name: (3R)-2-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-indol-3-yl)-3H-isoindol-1-one IUPAC Name: (3R)-2-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-indol-3-yl)-3H-isoindol-1-one Traditional Name: (3R)-2-homoveratryl-3-(1H-indol-3-yl)isoindolin-1-one Formula: C26H24N2O3 MolecularWeight: 412.48036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(C3=CC=CC=C3C2=O)C4=CNC5=CC=CC=C54)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2[C@H](C3=CC=CC=C3C2=O)C4=CNC5=CC=CC=C54)OC

InChI

InChI=1S/C26H24N2O3/c1-30-23-12-11-17(15-24(23)31-2)13-14-28-25(19-8-3-4-9-20(19)26(28)29)21-16-27-22-10-6-5-7-18(21)22/h3-12,15-16,25,27H,13-14H2,1-2H3/t25-/m1/s1