2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]ethanoic acid

Systemtic Name: 2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]ethanoic acid Openeye Name: 2-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]acetic acid CAS Name: 2-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]acetic acid IUPAC Name: 2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]acetic acid Traditional Name: 2-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]acetic acid Formula: C13H13NO4S MolecularWeight: 279.31162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)CC(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)CC(=O)O)OC

InChI

InChI=1S/C13H13NO4S/c1-17-10-4-3-8(5-11(10)18-2)9-7-19-12(14-9)6-13(15)16/h3-5,7H,6H2,1-2H3,(H,15,16)