(3S)-3-[2-(2,5-dimethoxyphenyl)-1H-indol-3-yl]-2-(3-methylbutyl)-3H-isoindol-1-one

Systemtic Name: (3S)-3-[2-(2,5-dimethoxyphenyl)-1H-indol-3-yl]-2-(3-methylbutyl)-3H-isoindol-1-one Openeye Name: (3S)-3-[2-(2,5-dimethoxyphenyl)-1H-indol-3-yl]-2-isopentyl-isoindolin-1-one CAS Name: (3S)-3-[2-(2,5-dimethoxyphenyl)-1H-indol-3-yl]-2-(3-methylbutyl)-3H-isoindol-1-one IUPAC Name: (3S)-3-[2-(2,5-dimethoxyphenyl)-1H-indol-3-yl]-2-(3-methylbutyl)-3H-isoindol-1-one Traditional Name: (3S)-3-[2-(2,5-dimethoxyphenyl)-1H-indol-3-yl]-2-isoamyl-isoindolin-1-one Formula: C29H30N2O3 MolecularWeight: 454.5601

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(C2=CC=CC=C2C1=O)C3=C(NC4=CC=CC=C43)C5=C(C=CC(=C5)OC)OC

Isomeric SMILES

CC(C)CCN1[C@@H](C2=CC=CC=C2C1=O)C3=C(NC4=CC=CC=C43)C5=C(C=CC(=C5)OC)OC

InChI

InChI=1S/C29H30N2O3/c1-18(2)15-16-31-28(20-9-5-6-10-21(20)29(31)32)26-22-11-7-8-12-24(22)30-27(26)23-17-19(33-3)13-14-25(23)34-4/h5-14,17-18,28,30H,15-16H2,1-4H3/t28-/m0/s1