3-(4-tert-butylphenyl)-4-cyano-5-(trifluoromethyl)thiophene-2-carboxylic acid

Systemtic Name: 3-(4-tert-butylphenyl)-4-cyano-5-(trifluoromethyl)thiophene-2-carboxylic acid Openeye Name: 3-(4-tert-butylphenyl)-4-cyano-5-(trifluoromethyl)thiophene-2-carboxylic acid CAS Name: 3-(4-tert-butylphenyl)-4-cyano-5-(trifluoromethyl)-2-thiophenecarboxylic acid IUPAC Name: 3-(4-tert-butylphenyl)-4-cyano-5-(trifluoromethyl)thiophene-2-carboxylic acid Traditional Name: 3-(4-tert-butylphenyl)-4-cyano-5-(trifluoromethyl)-2-thenoic acid Formula: C17H14F3NO2S MolecularWeight: 353.35877

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C(SC(=C2C#N)C(F)(F)F)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C(SC(=C2C#N)C(F)(F)F)C(=O)O

InChI

InChI=1S/C17H14F3NO2S/c1-16(2,3)10-6-4-9(5-7-10)12-11(8-21)14(17(18,19)20)24-13(12)15(22)23/h4-7H,1-3H3,(H,22,23)