4-[3-(3-oxidanyl-3-oxidanylidene-propanoyl)phenyl]-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-[3-(3-oxidanyl-3-oxidanylidene-propanoyl)phenyl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[3-(3-hydroxy-3-oxo-propanoyl)phenyl]thiazole-2-carboxylic acid CAS Name: 4-[3-(3-hydroxy-1,3-dioxopropyl)phenyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[3-(3-hydroxy-3-oxopropanoyl)phenyl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[3-(3-hydroxy-3-keto-propanoyl)phenyl]thiazole-2-carboxylic acid Formula: C13H9NO5S MolecularWeight: 291.27926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9NO5S/c15-10(5-11(16)17)8-3-1-2-7(4-8)9-6-20-12(14-9)13(18)19/h1-4,6H,5H2,(H,16,17)(H,18,19)