3-(1,3-benzothiazol-2-yl)-2-oxidanylidene-propanoic acid

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-2-oxidanylidene-propanoic acid Openeye Name: 3-(1,3-benzothiazol-2-yl)-2-oxo-propanoic acid CAS Name: 3-(1,3-benzothiazol-2-yl)-2-oxopropanoic acid IUPAC Name: 3-(1,3-benzothiazol-2-yl)-2-oxopropanoic acid Traditional Name: 3-(1,3-benzothiazol-2-yl)-2-keto-propionic acid Formula: C10H7NO3S MolecularWeight: 221.23248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CC(=O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CC(=O)C(=O)O

InChI

InChI=1S/C10H7NO3S/c12-7(10(13)14)5-9-11-6-3-1-2-4-8(6)15-9/h1-4H,5H2,(H,13,14)