4-[2-azanyl-3-methyl-1-oxidanyl-1-[2-(trifluoromethyl)-1,3-thiazol-4-yl]butyl]benzoic acid

Systemtic Name: 4-[2-azanyl-3-methyl-1-oxidanyl-1-[2-(trifluoromethyl)-1,3-thiazol-4-yl]butyl]benzoic acid Openeye Name: 4-[2-amino-1-hydroxy-3-methyl-1-[2-(trifluoromethyl)thiazol-4-yl]butyl]benzoic acid CAS Name: 4-[2-amino-1-hydroxy-3-methyl-1-[2-(trifluoromethyl)-4-thiazolyl]butyl]benzoic acid IUPAC Name: 4-[2-amino-1-hydroxy-3-methyl-1-[2-(trifluoromethyl)-1,3-thiazol-4-yl]butyl]benzoic acid Traditional Name: 4-[2-amino-1-hydroxy-3-methyl-1-[2-(trifluoromethyl)thiazol-4-yl]butyl]benzoic acid Formula: C16H17F3N2O3S MolecularWeight: 374.37799

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C1=CC=C(C=C1)C(=O)O)(C2=CSC(=N2)C(F)(F)F)O)N

Isomeric SMILES

CC(C)C(C(C1=CC=C(C=C1)C(=O)O)(C2=CSC(=N2)C(F)(F)F)O)N

InChI

InChI=1S/C16H17F3N2O3S/c1-8(2)12(20)15(24,10-5-3-9(4-6-10)13(22)23)11-7-25-14(21-11)16(17,18)19/h3-8,12,24H,20H2,1-2H3,(H,22,23)