3-[2-methoxy-5-(4-methylphenyl)phenyl]-7-methyl-2-(phenylmethyl)-3a,6,7,7a-tetrahydro-3H-isoindol-1-one

Systemtic Name: 3-[2-methoxy-5-(4-methylphenyl)phenyl]-7-methyl-2-(phenylmethyl)-3a,6,7,7a-tetrahydro-3H-isoindol-1-one Openeye Name: 2-benzyl-3-[2-methoxy-5-(p-tolyl)phenyl]-7-methyl-3a,6,7,7a-tetrahydro-3H-isoindol-1-one CAS Name: 3-[2-methoxy-5-(4-methylphenyl)phenyl]-7-methyl-2-(phenylmethyl)-3a,6,7,7a-tetrahydro-3H-isoindol-1-one IUPAC Name: 2-benzyl-3-[2-methoxy-5-(4-methylphenyl)phenyl]-7-methyl-3a,6,7,7a-tetrahydro-3H-isoindol-1-one Traditional Name: 2-benzyl-3-[2-methoxy-5-(p-tolyl)phenyl]-7-methyl-3a,6,7,7a-tetrahydro-3H-isoindol-1-one Formula: C30H31NO2 MolecularWeight: 437.57264

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC=CC2C1C(=O)N(C2C3=C(C=CC(=C3)C4=CC=C(C=C4)C)OC)CC5=CC=CC=C5

Isomeric SMILES

CC1CC=CC2C1C(=O)N(C2C3=C(C=CC(=C3)C4=CC=C(C=C4)C)OC)CC5=CC=CC=C5

InChI

InChI=1S/C30H31NO2/c1-20-12-14-23(15-13-20)24-16-17-27(33-3)26(18-24)29-25-11-7-8-21(2)28(25)30(32)31(29)19-22-9-5-4-6-10-22/h4-7,9-18,21,25,28-29H,8,19H2,1-3H3