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

Systemtic Name: 3-[2-(3-methylphenyl)-1,3-thiazol-4-yl]propanoic acid Openeye Name: 3-[2-(m-tolyl)thiazol-4-yl]propanoic acid CAS Name: 3-[2-(3-methylphenyl)-4-thiazolyl]propanoic acid IUPAC Name: 3-[2-(3-methylphenyl)-1,3-thiazol-4-yl]propanoic acid Traditional Name: 3-[2-(m-tolyl)thiazol-4-yl]propionic acid Formula: C13H13NO2S MolecularWeight: 247.31282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=CS2)CCC(=O)O

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=CS2)CCC(=O)O

InChI

InChI=1S/C13H13NO2S/c1-9-3-2-4-10(7-9)13-14-11(8-17-13)5-6-12(15)16/h2-4,7-8H,5-6H2,1H3,(H,15,16)