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

Systemtic Name: 3-[2-(4-methoxyphenyl)phenyl]-7a-methyl-2-(phenylmethyl)-3,3a,6,7-tetrahydroisoindol-1-one Openeye Name: 2-benzyl-3-[2-(4-methoxyphenyl)phenyl]-7a-methyl-3,3a,6,7-tetrahydroisoindol-1-one CAS Name: 3-[2-(4-methoxyphenyl)phenyl]-7a-methyl-2-(phenylmethyl)-3,3a,6,7-tetrahydroisoindol-1-one IUPAC Name: 2-benzyl-3-[2-(4-methoxyphenyl)phenyl]-7a-methyl-3,3a,6,7-tetrahydroisoindol-1-one Traditional Name: 2-benzyl-3-[2-(4-methoxyphenyl)phenyl]-7a-methyl-3,3a,6,7-tetrahydroisoindol-1-one Formula: C29H29NO2 MolecularWeight: 423.54606

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC=CC1C(N(C2=O)CC3=CC=CC=C3)C4=CC=CC=C4C5=CC=C(C=C5)OC

Isomeric SMILES

CC12CCC=CC1C(N(C2=O)CC3=CC=CC=C3)C4=CC=CC=C4C5=CC=C(C=C5)OC

InChI

InChI=1S/C29H29NO2/c1-29-19-9-8-14-26(29)27(30(28(29)31)20-21-10-4-3-5-11-21)25-13-7-6-12-24(25)22-15-17-23(32-2)18-16-22/h3-8,10-18,26-27H,9,19-20H2,1-2H3