ethyl 2-methyl-4-oxidanylidene-5-[[2-(trifluoromethyl)phenyl]methyl]pyrrole-3-carboxylate

Systemtic Name: ethyl 2-methyl-4-oxidanylidene-5-[[2-(trifluoromethyl)phenyl]methyl]pyrrole-3-carboxylate Openeye Name: ethyl 2-methyl-4-oxo-5-[[2-(trifluoromethyl)phenyl]methyl]pyrrole-3-carboxylate CAS Name: 2-methyl-4-oxo-5-[[2-(trifluoromethyl)phenyl]methyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-4-oxo-5-[[2-(trifluoromethyl)phenyl]methyl]pyrrole-3-carboxylate Traditional Name: 4-keto-2-methyl-5-[2-(trifluoromethyl)benzyl]pyrrole-3-carboxylic acid ethyl ester Formula: C16H14F3NO3 MolecularWeight: 325.28247

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C1=O)CC2=CC=CC=C2C(F)(F)F)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C1=O)CC2=CC=CC=C2C(F)(F)F)C

InChI

InChI=1S/C16H14F3NO3/c1-3-23-15(22)13-9(2)20-12(14(13)21)8-10-6-4-5-7-11(10)16(17,18)19/h4-7H,3,8H2,1-2H3