(3R)-2-tert-butyl-3-[1-methyl-2-(4-methylphenyl)indol-3-yl]-3H-isoindol-1-one

Systemtic Name: (3R)-2-tert-butyl-3-[1-methyl-2-(4-methylphenyl)indol-3-yl]-3H-isoindol-1-one Openeye Name: (3R)-2-tert-butyl-3-[1-methyl-2-(p-tolyl)indol-3-yl]isoindolin-1-one CAS Name: (3R)-2-tert-butyl-3-[1-methyl-2-(4-methylphenyl)-3-indolyl]-3H-isoindol-1-one IUPAC Name: (3R)-2-tert-butyl-3-[1-methyl-2-(4-methylphenyl)indol-3-yl]-3H-isoindol-1-one Traditional Name: (3R)-2-tert-butyl-3-[1-methyl-2-(p-tolyl)indol-3-yl]isoindolin-1-one Formula: C28H28N2O MolecularWeight: 408.53472

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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)N4C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2C)[C@H]4C5=CC=CC=C5C(=O)N4C(C)(C)C

InChI

InChI=1S/C28H28N2O/c1-18-14-16-19(17-15-18)25-24(22-12-8-9-13-23(22)29(25)5)26-20-10-6-7-11-21(20)27(31)30(26)28(2,3)4/h6-17,26H,1-5H3/t26-/m1/s1