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

Systemtic Name: 2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]ethanoic acid Openeye Name: 2-[4-(3,4-dimethylphenyl)thiazol-2-yl]acetic acid CAS Name: 2-[4-(3,4-dimethylphenyl)-2-thiazolyl]acetic acid IUPAC Name: 2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]acetic acid Traditional Name: 2-[4-(3,4-dimethylphenyl)thiazol-2-yl]acetic acid Formula: C13H13NO2S MolecularWeight: 247.31282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=N2)CC(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=N2)CC(=O)O)C

InChI

InChI=1S/C13H13NO2S/c1-8-3-4-10(5-9(8)2)11-7-17-12(14-11)6-13(15)16/h3-5,7H,6H2,1-2H3,(H,15,16)