(3S)-2-cyclohexyl-3-[1-methyl-2-(4-methylphenyl)indol-3-yl]-3H-isoindol-1-one

Systemtic Name: (3S)-2-cyclohexyl-3-[1-methyl-2-(4-methylphenyl)indol-3-yl]-3H-isoindol-1-one Openeye Name: (3S)-2-cyclohexyl-3-[1-methyl-2-(p-tolyl)indol-3-yl]isoindolin-1-one CAS Name: (3S)-2-cyclohexyl-3-[1-methyl-2-(4-methylphenyl)-3-indolyl]-3H-isoindol-1-one IUPAC Name: (3S)-2-cyclohexyl-3-[1-methyl-2-(4-methylphenyl)indol-3-yl]-3H-isoindol-1-one Traditional Name: (3S)-2-cyclohexyl-3-[1-methyl-2-(p-tolyl)indol-3-yl]isoindolin-1-one Formula: C30H30N2O MolecularWeight: 434.572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2C)C4C5=CC=CC=C5C(=O)N4C6CCCCC6

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2C)[C@@H]4C5=CC=CC=C5C(=O)N4C6CCCCC6

InChI

InChI=1S/C30H30N2O/c1-20-16-18-21(19-17-20)28-27(25-14-8-9-15-26(25)31(28)2)29-23-12-6-7-13-24(23)30(33)32(29)22-10-4-3-5-11-22/h6-9,12-19,22,29H,3-5,10-11H2,1-2H3/t29-/m0/s1