2-(2-ethoxy-2-oxidanylidene-ethyl)-1-methyl-5-thiophen-2-ylcarbonyl-4-(trifluoromethyl)pyrrole-3-carboxylic acid

Systemtic Name: 2-(2-ethoxy-2-oxidanylidene-ethyl)-1-methyl-5-thiophen-2-ylcarbonyl-4-(trifluoromethyl)pyrrole-3-carboxylic acid Openeye Name: 2-(2-ethoxy-2-oxo-ethyl)-1-methyl-5-(thiophene-2-carbonyl)-4-(trifluoromethyl)pyrrole-3-carboxylic acid CAS Name: 2-(2-ethoxy-2-oxoethyl)-1-methyl-5-[oxo(thiophen-2-yl)methyl]-4-(trifluoromethyl)-3-pyrrolecarboxylic acid IUPAC Name: 2-(2-ethoxy-2-oxoethyl)-1-methyl-5-(thiophene-2-carbonyl)-4-(trifluoromethyl)pyrrole-3-carboxylic acid Traditional Name: 2-(2-ethoxy-2-keto-ethyl)-1-methyl-5-(2-thenoyl)-4-(trifluoromethyl)pyrrole-3-carboxylic acid Formula: C16H14F3NO5S MolecularWeight: 389.34627

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C(=C(N1C)C(=O)C2=CC=CS2)C(F)(F)F)C(=O)O

Isomeric SMILES

CCOC(=O)CC1=C(C(=C(N1C)C(=O)C2=CC=CS2)C(F)(F)F)C(=O)O

InChI

InChI=1S/C16H14F3NO5S/c1-3-25-10(21)7-8-11(15(23)24)12(16(17,18)19)13(20(8)2)14(22)9-5-4-6-26-9/h4-6H,3,7H2,1-2H3,(H,23,24)