2-[[(1S)-3-oxidanylidene-2-phenyl-1H-isoindol-1-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[(1S)-3-oxidanylidene-2-phenyl-1H-isoindol-1-yl]sulfanyl]ethanoate Openeye Name: 2-[(1S)-3-oxo-2-phenyl-isoindolin-1-yl]sulfanylacetate CAS Name: 2-[[(1S)-3-oxo-2-phenyl-1H-isoindol-1-yl]thio]acetate IUPAC Name: 2-[[(1S)-3-oxo-2-phenyl-1H-isoindol-1-yl]sulfanyl]acetate Traditional Name: 2-[[(1S)-3-keto-2-phenyl-isoindolin-1-yl]thio]acetate Formula: C16H12NO3S- MolecularWeight: 298.33638

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(C3=CC=CC=C3C2=O)SCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2[C@H](C3=CC=CC=C3C2=O)SCC(=O)[O-]

InChI

InChI=1S/C16H13NO3S/c18-14(19)10-21-16-13-9-5-4-8-12(13)15(20)17(16)11-6-2-1-3-7-11/h1-9,16H,10H2,(H,18,19)/p-1/t16-/m0/s1