methyl 4-[4-cyano-3-(trifluoromethyl)phenyl]-1,2,5-trimethyl-pyrrole-3-carboxylate

Systemtic Name: methyl 4-[4-cyano-3-(trifluoromethyl)phenyl]-1,2,5-trimethyl-pyrrole-3-carboxylate Openeye Name: methyl 4-[4-cyano-3-(trifluoromethyl)phenyl]-1,2,5-trimethyl-pyrrole-3-carboxylate CAS Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-1,2,5-trimethyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[4-cyano-3-(trifluoromethyl)phenyl]-1,2,5-trimethylpyrrole-3-carboxylate Traditional Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-1,2,5-trimethyl-pyrrole-3-carboxylic acid methyl ester Formula: C17H15F3N2O2 MolecularWeight: 336.30841

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C)C)C(=O)OC)C2=CC(=C(C=C2)C#N)C(F)(F)F

Isomeric SMILES

CC1=C(C(=C(N1C)C)C(=O)OC)C2=CC(=C(C=C2)C#N)C(F)(F)F

InChI

InChI=1S/C17H15F3N2O2/c1-9-14(15(16(23)24-4)10(2)22(9)3)11-5-6-12(8-21)13(7-11)17(18,19)20/h5-7H,1-4H3