2-[[3,5-bis(trifluoromethyl)phenyl]carbamoylamino]cyclohexane-1-carboxylic acid

Systemtic Name: 2-[[3,5-bis(trifluoromethyl)phenyl]carbamoylamino]cyclohexane-1-carboxylic acid Openeye Name: 2-[[3,5-bis(trifluoromethyl)phenyl]carbamoylamino]cyclohexanecarboxylic acid CAS Name: 2-[[[3,5-bis(trifluoromethyl)anilino]-oxomethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[[3,5-bis(trifluoromethyl)phenyl]carbamoylamino]cyclohexane-1-carboxylic acid Traditional Name: 2-[[3,5-bis(trifluoromethyl)phenyl]carbamoylamino]cyclohexanecarboxylic acid Formula: C16H16F6N2O3 MolecularWeight: 398.300259

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)O)NC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1CCC(C(C1)C(=O)O)NC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C16H16F6N2O3/c17-15(18,19)8-5-9(16(20,21)22)7-10(6-8)23-14(27)24-12-4-2-1-3-11(12)13(25)26/h5-7,11-12H,1-4H2,(H,25,26)(H2,23,24,27)