3-(3,4-dimethoxyphenyl)-1,2-thiazole-4-carboxylic acid

Systemtic Name: 3-(3,4-dimethoxyphenyl)-1,2-thiazole-4-carboxylic acid Openeye Name: 3-(3,4-dimethoxyphenyl)isothiazole-4-carboxylic acid CAS Name: 3-(3,4-dimethoxyphenyl)-4-isothiazolecarboxylic acid IUPAC Name: 3-(3,4-dimethoxyphenyl)-1,2-thiazole-4-carboxylic acid Traditional Name: 3-(3,4-dimethoxyphenyl)isothiazole-4-carboxylic acid Formula: C12H11NO4S MolecularWeight: 265.28504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NSC=C2C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NSC=C2C(=O)O)OC

InChI

InChI=1S/C12H11NO4S/c1-16-9-4-3-7(5-10(9)17-2)11-8(12(14)15)6-18-13-11/h3-6H,1-2H3,(H,14,15)