dimethyl 3-(3,4-dichlorophenyl)-1,2-thiazole-4,5-dicarboxylate

Systemtic Name: dimethyl 3-(3,4-dichlorophenyl)-1,2-thiazole-4,5-dicarboxylate Openeye Name: dimethyl 3-(3,4-dichlorophenyl)isothiazole-4,5-dicarboxylate CAS Name: 3-(3,4-dichlorophenyl)isothiazole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-(3,4-dichlorophenyl)-1,2-thiazole-4,5-dicarboxylate Traditional Name: 3-(3,4-dichlorophenyl)isothiazole-4,5-dicarboxylic acid dimethyl ester Formula: C13H9Cl2NO4S MolecularWeight: 346.18586

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SN=C1C2=CC(=C(C=C2)Cl)Cl)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(SN=C1C2=CC(=C(C=C2)Cl)Cl)C(=O)OC

InChI

InChI=1S/C13H9Cl2NO4S/c1-19-12(17)9-10(16-21-11(9)13(18)20-2)6-3-4-7(14)8(15)5-6/h3-5H,1-2H3