ethyl (1S,6R)-6-methyl-2-oxidanylidene-4-[[3-(trifluoromethyl)phenyl]amino]cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl (1S,6R)-6-methyl-2-oxidanylidene-4-[[3-(trifluoromethyl)phenyl]amino]cyclohex-3-ene-1-carboxylate Openeye Name: ethyl (1S,6R)-6-methyl-2-oxo-4-[3-(trifluoromethyl)anilino]cyclohex-3-ene-1-carboxylate CAS Name: (1S,6R)-6-methyl-2-oxo-4-[3-(trifluoromethyl)anilino]-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,6R)-6-methyl-2-oxo-4-[3-(trifluoromethyl)anilino]cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6R)-2-keto-6-methyl-4-[3-(trifluoromethyl)anilino]cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C17H18F3NO3 MolecularWeight: 341.32493

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC(=CC1=O)NC2=CC=CC(=C2)C(F)(F)F)C

Isomeric SMILES

CCOC(=O)[C@H]1[C@@H](CC(=CC1=O)NC2=CC=CC(=C2)C(F)(F)F)C

InChI

InChI=1S/C17H18F3NO3/c1-3-24-16(23)15-10(2)7-13(9-14(15)22)21-12-6-4-5-11(8-12)17(18,19)20/h4-6,8-10,15,21H,3,7H2,1-2H3/t10-,15+/m1/s1