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

Systemtic Name: 3-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]methyl]benzoic acid Openeye Name: 3-[[4-(p-tolyl)thiazol-2-yl]methyl]benzoic acid CAS Name: 3-[[4-(4-methylphenyl)-2-thiazolyl]methyl]benzoic acid IUPAC Name: 3-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]methyl]benzoic acid Traditional Name: 3-[[4-(p-tolyl)thiazol-2-yl]methyl]benzoic acid Formula: C18H15NO2S MolecularWeight: 309.3822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)CC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)CC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C18H15NO2S/c1-12-5-7-14(8-6-12)16-11-22-17(19-16)10-13-3-2-4-15(9-13)18(20)21/h2-9,11H,10H2,1H3,(H,20,21)