3-oxidanylidene-3-[3-(1,3-thiazol-4-yl)phenyl]propanoic acid

Systemtic Name: 3-oxidanylidene-3-[3-(1,3-thiazol-4-yl)phenyl]propanoic acid Openeye Name: 3-oxo-3-(3-thiazol-4-ylphenyl)propanoic acid CAS Name: 3-oxo-3-[3-(4-thiazolyl)phenyl]propanoic acid IUPAC Name: 3-oxo-3-[3-(1,3-thiazol-4-yl)phenyl]propanoic acid Traditional Name: 3-keto-3-(3-thiazol-4-ylphenyl)propionic acid Formula: C12H9NO3S MolecularWeight: 247.26976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)CC(=O)O)C2=CSC=N2

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)CC(=O)O)C2=CSC=N2

InChI

InChI=1S/C12H9NO3S/c14-11(5-12(15)16)9-3-1-2-8(4-9)10-6-17-7-13-10/h1-4,6-7H,5H2,(H,15,16)