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

Systemtic Name: 2-heptan-2-yl-3-[1-methyl-2-(4-methylphenyl)indol-3-yl]-3H-isoindol-1-one Openeye Name: 2-(1-methylhexyl)-3-[1-methyl-2-(p-tolyl)indol-3-yl]isoindolin-1-one CAS Name: 2-heptan-2-yl-3-[1-methyl-2-(4-methylphenyl)-3-indolyl]-3H-isoindol-1-one IUPAC Name: 2-heptan-2-yl-3-[1-methyl-2-(4-methylphenyl)indol-3-yl]-3H-isoindol-1-one Traditional Name: 2-(1-methylhexyl)-3-[1-methyl-2-(p-tolyl)indol-3-yl]isoindolin-1-one Formula: C31H34N2O MolecularWeight: 450.61446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)N1C(C2=CC=CC=C2C1=O)C3=C(N(C4=CC=CC=C43)C)C5=CC=C(C=C5)C

Isomeric SMILES

CCCCCC(C)N1C(C2=CC=CC=C2C1=O)C3=C(N(C4=CC=CC=C43)C)C5=CC=C(C=C5)C

InChI

InChI=1S/C31H34N2O/c1-5-6-7-12-22(3)33-30(24-13-8-9-14-25(24)31(33)34)28-26-15-10-11-16-27(26)32(4)29(28)23-19-17-21(2)18-20-23/h8-11,13-20,22,30H,5-7,12H2,1-4H3