6-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]-3-methyl-cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]-3-methyl-cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]-3-methyl-cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[[3,5-bis(trifluoromethyl)anilino]-oxomethyl]-3-methyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]-3-methylcyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]-3-methyl-cyclohex-3-ene-1-carboxylic acid Formula: C17H15F6NO3 MolecularWeight: 395.296319

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(C(C1)C(=O)O)C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC1=CCC(C(C1)C(=O)O)C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C17H15F6NO3/c1-8-2-3-12(13(4-8)15(26)27)14(25)24-11-6-9(16(18,19)20)5-10(7-11)17(21,22)23/h2,5-7,12-13H,3-4H2,1H3,(H,24,25)(H,26,27)