(3S,3aS)-3-phenyl-2-(phenylmethyl)-3a,4,5,6-tetrahydro-3H-isoindol-1-one

Systemtic Name: (3S,3aS)-3-phenyl-2-(phenylmethyl)-3a,4,5,6-tetrahydro-3H-isoindol-1-one Openeye Name: (3S,3aS)-2-benzyl-3-phenyl-3a,4,5,6-tetrahydro-3H-isoindol-1-one CAS Name: (3S,3aS)-3-phenyl-2-(phenylmethyl)-3a,4,5,6-tetrahydro-3H-isoindol-1-one IUPAC Name: (3S,3aS)-2-benzyl-3-phenyl-3a,4,5,6-tetrahydro-3H-isoindol-1-one Traditional Name: (3S,3aS)-2-benzyl-3-phenyl-3a,4,5,6-tetrahydro-3H-isoindol-1-one Formula: C21H21NO MolecularWeight: 303.39754

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=C2C(C1)C(N(C2=O)CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC=C2[C@H](C1)[C@H](N(C2=O)CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H21NO/c23-21-19-14-8-7-13-18(19)20(17-11-5-2-6-12-17)22(21)15-16-9-3-1-4-10-16/h1-6,9-12,14,18,20H,7-8,13,15H2/t18-,20+/m0/s1