ethyl 2-(4-chloranylphenoxy)carbothioyl-5-oxidanylidene-1,2-oxazole-4-carboxylate

Systemtic Name: ethyl 2-(4-chloranylphenoxy)carbothioyl-5-oxidanylidene-1,2-oxazole-4-carboxylate Openeye Name: ethyl 2-(4-chlorophenoxy)carbothioyl-5-oxo-isoxazole-4-carboxylate CAS Name: 2-[(4-chlorophenoxy)-sulfanylidenemethyl]-5-oxo-4-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-chlorophenoxy)carbothioyl-5-oxo-1,2-oxazole-4-carboxylate Traditional Name: 2-(4-chlorophenoxy)carbothioyl-5-keto-3-isoxazoline-4-carboxylic acid ethyl ester Formula: C13H10ClNO5S MolecularWeight: 327.7402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(OC1=O)C(=S)OC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1=CN(OC1=O)C(=S)OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H10ClNO5S/c1-2-18-11(16)10-7-15(20-12(10)17)13(21)19-9-5-3-8(14)4-6-9/h3-7H,2H2,1H3