3-(1,2-dimethylindol-3-yl)-2-(4-phenylbutan-2-yl)-4,5,6,7-tetrahydro-3H-isoindol-1-one

Systemtic Name: 3-(1,2-dimethylindol-3-yl)-2-(4-phenylbutan-2-yl)-4,5,6,7-tetrahydro-3H-isoindol-1-one Openeye Name: 3-(1,2-dimethylindol-3-yl)-2-(1-methyl-3-phenyl-propyl)-4,5,6,7-tetrahydro-3H-isoindol-1-one CAS Name: 3-(1,2-dimethyl-3-indolyl)-2-(4-phenylbutan-2-yl)-4,5,6,7-tetrahydro-3H-isoindol-1-one IUPAC Name: 3-(1,2-dimethylindol-3-yl)-2-(4-phenylbutan-2-yl)-4,5,6,7-tetrahydro-3H-isoindol-1-one Traditional Name: 3-(1,2-dimethylindol-3-yl)-2-(1-methyl-3-phenyl-propyl)-4,5,6,7-tetrahydro-3H-isoindol-1-one Formula: C28H32N2O MolecularWeight: 412.56648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1C)C3C4=C(CCCC4)C(=O)N3C(C)CCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1C)C3C4=C(CCCC4)C(=O)N3C(C)CCC5=CC=CC=C5

InChI

InChI=1S/C28H32N2O/c1-19(17-18-21-11-5-4-6-12-21)30-27(22-13-7-8-14-23(22)28(30)31)26-20(2)29(3)25-16-10-9-15-24(25)26/h4-6,9-12,15-16,19,27H,7-8,13-14,17-18H2,1-3H3