[(1S)-3-oxidanylidene-2-(thiophen-2-ylmethyl)-1H-isoindol-1-yl] benzoate

Systemtic Name: [(1S)-3-oxidanylidene-2-(thiophen-2-ylmethyl)-1H-isoindol-1-yl] benzoate Openeye Name: [(1S)-3-oxo-2-(2-thienylmethyl)isoindolin-1-yl] benzoate CAS Name: benzoic acid [(1S)-3-oxo-2-(thiophen-2-ylmethyl)-1H-isoindol-1-yl] ester IUPAC Name: [(1S)-3-oxo-2-(thiophen-2-ylmethyl)-1H-isoindol-1-yl] benzoate Traditional Name: benzoic acid [(1S)-3-keto-2-(2-thenyl)isoindolin-1-yl] ester Formula: C20H15NO3S MolecularWeight: 349.403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2C3=CC=CC=C3C(=O)N2CC4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)O[C@H]2C3=CC=CC=C3C(=O)N2CC4=CC=CS4

InChI

InChI=1S/C20H15NO3S/c22-18-16-10-4-5-11-17(16)19(21(18)13-15-9-6-12-25-15)24-20(23)14-7-2-1-3-8-14/h1-12,19H,13H2/t19-/m0/s1