ethyl (4S)-4-(3,5-dimethyl-4-oxidanyl-phenyl)-1,2-dimethyl-5-oxidanylidene-4-(trifluoromethyl)pyrrole-3-carboxylate

Systemtic Name: ethyl (4S)-4-(3,5-dimethyl-4-oxidanyl-phenyl)-1,2-dimethyl-5-oxidanylidene-4-(trifluoromethyl)pyrrole-3-carboxylate Openeye Name: ethyl (4S)-4-(4-hydroxy-3,5-dimethyl-phenyl)-1,2-dimethyl-5-oxo-4-(trifluoromethyl)pyrrole-3-carboxylate CAS Name: (4S)-4-(4-hydroxy-3,5-dimethylphenyl)-1,2-dimethyl-5-oxo-4-(trifluoromethyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-(4-hydroxy-3,5-dimethylphenyl)-1,2-dimethyl-5-oxo-4-(trifluoromethyl)pyrrole-3-carboxylate Traditional Name: (4S)-4-(4-hydroxy-3,5-dimethyl-phenyl)-5-keto-1,2-dimethyl-4-(trifluoromethyl)-2-pyrroline-3-carboxylic acid ethyl ester Formula: C18H20F3NO4 MolecularWeight: 371.35091

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)C1(C2=CC(=C(C(=C2)C)O)C)C(F)(F)F)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)[C@@]1(C2=CC(=C(C(=C2)C)O)C)C(F)(F)F)C)C

InChI

InChI=1S/C18H20F3NO4/c1-6-26-15(24)13-11(4)22(5)16(25)17(13,18(19,20)21)12-7-9(2)14(23)10(3)8-12/h7-8,23H,6H2,1-5H3/t17-/m0/s1