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

Systemtic Name: 3-[2-methoxy-5-(4-methoxyphenyl)phenyl]-7a-methyl-2-(phenylmethyl)-3,3a,6,7-tetrahydroisoindol-1-one Openeye Name: 2-benzyl-3-[2-methoxy-5-(4-methoxyphenyl)phenyl]-7a-methyl-3,3a,6,7-tetrahydroisoindol-1-one CAS Name: 3-[2-methoxy-5-(4-methoxyphenyl)phenyl]-7a-methyl-2-(phenylmethyl)-3,3a,6,7-tetrahydroisoindol-1-one IUPAC Name: 2-benzyl-3-[2-methoxy-5-(4-methoxyphenyl)phenyl]-7a-methyl-3,3a,6,7-tetrahydroisoindol-1-one Traditional Name: 2-benzyl-3-[2-methoxy-5-(4-methoxyphenyl)phenyl]-7a-methyl-3,3a,6,7-tetrahydroisoindol-1-one Formula: C30H31NO3 MolecularWeight: 453.57204

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC=CC1C(N(C2=O)CC3=CC=CC=C3)C4=C(C=CC(=C4)C5=CC=C(C=C5)OC)OC

Isomeric SMILES

CC12CCC=CC1C(N(C2=O)CC3=CC=CC=C3)C4=C(C=CC(=C4)C5=CC=C(C=C5)OC)OC

InChI

InChI=1S/C30H31NO3/c1-30-18-8-7-11-26(30)28(31(29(30)32)20-21-9-5-4-6-10-21)25-19-23(14-17-27(25)34-3)22-12-15-24(33-2)16-13-22/h4-7,9-17,19,26,28H,8,18,20H2,1-3H3