methyl 3-[[3,5-bis(trifluoromethyl)cyclohexyl]carbamoyl]benzoate

Systemtic Name: methyl 3-[[3,5-bis(trifluoromethyl)cyclohexyl]carbamoyl]benzoate Openeye Name: methyl 3-[[3,5-bis(trifluoromethyl)cyclohexyl]carbamoyl]benzoate CAS Name: 3-[[[3,5-bis(trifluoromethyl)cyclohexyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[3,5-bis(trifluoromethyl)cyclohexyl]carbamoyl]benzoate Traditional Name: 3-[[3,5-bis(trifluoromethyl)cyclohexyl]carbamoyl]benzoic acid methyl ester Formula: C17H17F6NO3 MolecularWeight: 397.312199

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C(=O)NC2CC(CC(C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C(=O)NC2CC(CC(C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C17H17F6NO3/c1-27-15(26)10-4-2-3-9(5-10)14(25)24-13-7-11(16(18,19)20)6-12(8-13)17(21,22)23/h2-5,11-13H,6-8H2,1H3,(H,24,25)