methyl 4-phenylazanyl-1-[2-[3-(trifluoromethyl)phenyl]ethyl]piperidine-4-carboxylate

Systemtic Name: methyl 4-phenylazanyl-1-[2-[3-(trifluoromethyl)phenyl]ethyl]piperidine-4-carboxylate Openeye Name: methyl 4-anilino-1-[2-[3-(trifluoromethyl)phenyl]ethyl]piperidine-4-carboxylate CAS Name: 4-anilino-1-[2-[3-(trifluoromethyl)phenyl]ethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-anilino-1-[2-[3-(trifluoromethyl)phenyl]ethyl]piperidine-4-carboxylate Traditional Name: 4-anilino-1-[2-[3-(trifluoromethyl)phenyl]ethyl]isonipecotic acid methyl ester Formula: C22H25F3N2O2 MolecularWeight: 406.44131

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCN(CC1)CCC2=CC(=CC=C2)C(F)(F)F)NC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1(CCN(CC1)CCC2=CC(=CC=C2)C(F)(F)F)NC3=CC=CC=C3

InChI

InChI=1S/C22H25F3N2O2/c1-29-20(28)21(26-19-8-3-2-4-9-19)11-14-27(15-12-21)13-10-17-6-5-7-18(16-17)22(23,24)25/h2-9,16,26H,10-15H2,1H3