3-[(4-chloranyl-5-methanoyl-2-oxidanylidene-1,3-thiazol-3-yl)methyl]benzoate

Systemtic Name: 3-[(4-chloranyl-5-methanoyl-2-oxidanylidene-1,3-thiazol-3-yl)methyl]benzoate Openeye Name: 3-[(4-chloro-5-formyl-2-oxo-thiazol-3-yl)methyl]benzoate CAS Name: 3-[(4-chloro-5-formyl-2-oxo-3-thiazolyl)methyl]benzoate IUPAC Name: 3-[(4-chloro-5-formyl-2-oxo-1,3-thiazol-3-yl)methyl]benzoate Traditional Name: 3-[(4-chloro-5-formyl-2-keto-4-thiazolin-3-yl)methyl]benzoate Formula: C12H7ClNO4S- MolecularWeight: 296.70628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CN2C(=C(SC2=O)C=O)Cl)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)CN2C(=C(SC2=O)C=O)Cl)C(=O)[O-]

InChI

InChI=1S/C12H8ClNO4S/c13-10-9(6-15)19-12(18)14(10)5-7-2-1-3-8(4-7)11(16)17/h1-4,6H,5H2,(H,16,17)/p-1