(2S)-2-(3-oxidanylidene-1,2-benzothiazol-2-yl)propanoate

Systemtic Name: (2S)-2-(3-oxidanylidene-1,2-benzothiazol-2-yl)propanoate Openeye Name: (2S)-2-(3-oxo-1,2-benzothiazol-2-yl)propanoate CAS Name: (2S)-2-(3-oxo-1,2-benzothiazol-2-yl)propanoate IUPAC Name: (2S)-2-(3-oxo-1,2-benzothiazol-2-yl)propanoate Traditional Name: (2S)-2-(3-keto-1,2-benzothiazol-2-yl)propionate Formula: C10H8NO3S- MolecularWeight: 222.24042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])N1C(=O)C2=CC=CC=C2S1

Isomeric SMILES

C[C@@H](C(=O)[O-])N1C(=O)C2=CC=CC=C2S1

InChI

InChI=1S/C10H9NO3S/c1-6(10(13)14)11-9(12)7-4-2-3-5-8(7)15-11/h2-6H,1H3,(H,13,14)/p-1/t6-/m0/s1