(3S)-1-cycloheptyl-6-oxidanylidene-N-[[3-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-cycloheptyl-6-oxidanylidene-N-[[3-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxamide Openeye Name: (3S)-1-cycloheptyl-6-oxo-N-[[3-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxamide CAS Name: (3S)-1-cycloheptyl-6-oxo-N-[[3-(trifluoromethyl)phenyl]methyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-cycloheptyl-6-oxo-N-[[3-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxamide Traditional Name: (3S)-1-cycloheptyl-6-keto-N-[3-(trifluoromethyl)benzyl]nipecotamide Formula: C21H27F3N2O2 MolecularWeight: 396.44649

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)N2CC(CCC2=O)C(=O)NCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1CCCC(CC1)N2C[C@H](CCC2=O)C(=O)NCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C21H27F3N2O2/c22-21(23,24)17-7-5-6-15(12-17)13-25-20(28)16-10-11-19(27)26(14-16)18-8-3-1-2-4-9-18/h5-7,12,16,18H,1-4,8-11,13-14H2,(H,25,28)/t16-/m0/s1