[(1S)-1-(4-methylphenyl)-2-[(1S)-3-oxidanylidene-1,2-dihydroisoindol-1-yl]ethyl] benzoate

Systemtic Name: [(1S)-1-(4-methylphenyl)-2-[(1S)-3-oxidanylidene-1,2-dihydroisoindol-1-yl]ethyl] benzoate Openeye Name: [(1S)-2-[(1S)-3-oxoisoindolin-1-yl]-1-(p-tolyl)ethyl] benzoate CAS Name: benzoic acid [(1S)-1-(4-methylphenyl)-2-[(1S)-3-oxo-1,2-dihydroisoindol-1-yl]ethyl] ester IUPAC Name: [(1S)-1-(4-methylphenyl)-2-[(1S)-3-oxo-1,2-dihydroisoindol-1-yl]ethyl] benzoate Traditional Name: benzoic acid [(1S)-2-[(1S)-3-ketoisoindolin-1-yl]-1-(p-tolyl)ethyl] ester Formula: C24H21NO3 MolecularWeight: 371.42844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC2C3=CC=CC=C3C(=O)N2)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C[C@H]2C3=CC=CC=C3C(=O)N2)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H21NO3/c1-16-11-13-17(14-12-16)22(28-24(27)18-7-3-2-4-8-18)15-21-19-9-5-6-10-20(19)23(26)25-21/h2-14,21-22H,15H2,1H3,(H,25,26)/t21-,22-/m0/s1