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

Systemtic Name: 3-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]propanoic acid Openeye Name: 3-[4-(3,4-dimethylphenyl)thiazol-2-yl]propanoic acid CAS Name: 3-[4-(3,4-dimethylphenyl)-2-thiazolyl]propanoic acid IUPAC Name: 3-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]propanoic acid Traditional Name: 3-[4-(3,4-dimethylphenyl)thiazol-2-yl]propionic acid Formula: C14H15NO2S MolecularWeight: 261.3394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15NO2S/c1-9-3-4-11(7-10(9)2)12-8-18-13(15-12)5-6-14(16)17/h3-4,7-8H,5-6H2,1-2H3,(H,16,17)