1-azanyl-2-[2-[4-(trifluoromethyl)phenyl]phenyl]carbonyl-cyclohexane-1-carboxylic acid

Systemtic Name: 1-azanyl-2-[2-[4-(trifluoromethyl)phenyl]phenyl]carbonyl-cyclohexane-1-carboxylic acid Openeye Name: 1-amino-2-[2-[4-(trifluoromethyl)phenyl]benzoyl]cyclohexanecarboxylic acid CAS Name: 1-amino-2-[oxo-[2-[4-(trifluoromethyl)phenyl]phenyl]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 1-amino-2-[2-[4-(trifluoromethyl)phenyl]benzoyl]cyclohexane-1-carboxylic acid Traditional Name: 1-amino-2-[2-[4-(trifluoromethyl)phenyl]benzoyl]cyclohexanecarboxylic acid Formula: C21H20F3NO3 MolecularWeight: 391.38361

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)C2=CC=CC=C2C3=CC=C(C=C3)C(F)(F)F)(C(=O)O)N

Isomeric SMILES

C1CCC(C(C1)C(=O)C2=CC=CC=C2C3=CC=C(C=C3)C(F)(F)F)(C(=O)O)N

InChI

InChI=1S/C21H20F3NO3/c22-21(23,24)14-10-8-13(9-11-14)15-5-1-2-6-16(15)18(26)17-7-3-4-12-20(17,25)19(27)28/h1-2,5-6,8-11,17H,3-4,7,12,25H2,(H,27,28)