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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=C(C=C2)OC)C3C4C=CCCC4(C(=O)N3CC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=C(C=C2)OC)C3C4C=CCCC4(C(=O)N3CC5=CC=CC=C5)C

InChI

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