(3R,3aR,7aR)-7a-methyl-3-(3-methylphenyl)-2-(phenylmethyl)-3,3a,6,7-tetrahydroisoindol-1-one

Systemtic Name: (3R,3aR,7aR)-7a-methyl-3-(3-methylphenyl)-2-(phenylmethyl)-3,3a,6,7-tetrahydroisoindol-1-one Openeye Name: (3R,3aR,7aR)-2-benzyl-7a-methyl-3-(m-tolyl)-3,3a,6,7-tetrahydroisoindol-1-one CAS Name: (3R,3aR,7aR)-7a-methyl-3-(3-methylphenyl)-2-(phenylmethyl)-3,3a,6,7-tetrahydroisoindol-1-one IUPAC Name: (3R,3aR,7aR)-2-benzyl-7a-methyl-3-(3-methylphenyl)-3,3a,6,7-tetrahydroisoindol-1-one Traditional Name: (3R,3aR,7aR)-2-benzyl-7a-methyl-3-(m-tolyl)-3,3a,6,7-tetrahydroisoindol-1-one Formula: C23H25NO MolecularWeight: 331.4507

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2C3C=CCCC3(C(=O)N2CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=CC(=C1)[C@H]2[C@@H]3C=CCC[C@]3(C(=O)N2CC4=CC=CC=C4)C

InChI

InChI=1S/C23H25NO/c1-17-9-8-12-19(15-17)21-20-13-6-7-14-23(20,2)22(25)24(21)16-18-10-4-3-5-11-18/h3-6,8-13,15,20-21H,7,14,16H2,1-2H3/t20-,21-,23+/m0/s1