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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=CS2)CC(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=CS2)CC(=O)O

InChI

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