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

Systemtic Name: 2-(2-ethoxy-2-oxidanylidene-ethyl)-5-(4-methoxyphenyl)carbonyl-1-methyl-4-(trifluoromethyl)pyrrole-3-carboxylic acid Openeye Name: 2-(2-ethoxy-2-oxo-ethyl)-5-(4-methoxybenzoyl)-1-methyl-4-(trifluoromethyl)pyrrole-3-carboxylic acid CAS Name: 2-(2-ethoxy-2-oxoethyl)-5-[(4-methoxyphenyl)-oxomethyl]-1-methyl-4-(trifluoromethyl)-3-pyrrolecarboxylic acid IUPAC Name: 2-(2-ethoxy-2-oxoethyl)-5-(4-methoxybenzoyl)-1-methyl-4-(trifluoromethyl)pyrrole-3-carboxylic acid Traditional Name: 2-(2-ethoxy-2-keto-ethyl)-1-methyl-5-p-anisoyl-4-(trifluoromethyl)pyrrole-3-carboxylic acid Formula: C19H18F3NO6 MolecularWeight: 413.34453

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18F3NO6/c1-4-29-13(24)9-12-14(18(26)27)15(19(20,21)22)16(23(12)2)17(25)10-5-7-11(28-3)8-6-10/h5-8H,4,9H2,1-3H3,(H,26,27)