ethyl 4-(5-chloranyl-3-oxidanylidene-1,2-thiazol-2-yl)benzoate

Systemtic Name: ethyl 4-(5-chloranyl-3-oxidanylidene-1,2-thiazol-2-yl)benzoate Openeye Name: ethyl 4-(5-chloro-3-oxo-isothiazol-2-yl)benzoate CAS Name: 4-(5-chloro-3-oxo-2-isothiazolyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(5-chloro-3-oxo-1,2-thiazol-2-yl)benzoate Traditional Name: 4-(5-chloro-3-keto-4-isothiazolin-2-yl)benzoic acid ethyl ester Formula: C12H10ClNO3S MolecularWeight: 283.7307

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C=C(S2)Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C=C(S2)Cl

InChI

InChI=1S/C12H10ClNO3S/c1-2-17-12(16)8-3-5-9(6-4-8)14-11(15)7-10(13)18-14/h3-7H,2H2,1H3