(2S,4R)-4-butyl-N-(pyridin-2-ylmethyl)-2-(trifluoromethyl)oxepane-2-carboxamide

Systemtic Name: (2S,4R)-4-butyl-N-(pyridin-2-ylmethyl)-2-(trifluoromethyl)oxepane-2-carboxamide Openeye Name: (2S,4R)-4-butyl-N-(2-pyridylmethyl)-2-(trifluoromethyl)oxepane-2-carboxamide CAS Name: (2S,4R)-4-butyl-N-(2-pyridinylmethyl)-2-(trifluoromethyl)-2-oxepanecarboxamide IUPAC Name: (2S,4R)-4-butyl-N-(pyridin-2-ylmethyl)-2-(trifluoromethyl)oxepane-2-carboxamide Traditional Name: (2S,4R)-4-butyl-N-(2-pyridylmethyl)-2-(trifluoromethyl)oxepane-2-carboxamide Formula: C18H25F3N2O2 MolecularWeight: 358.39851

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCCOC(C1)(C(=O)NCC2=CC=CC=N2)C(F)(F)F

Isomeric SMILES

CCCC[C@@H]1CCCO[C@@](C1)(C(=O)NCC2=CC=CC=N2)C(F)(F)F

InChI

InChI=1S/C18H25F3N2O2/c1-2-3-7-14-8-6-11-25-17(12-14,18(19,20)21)16(24)23-13-15-9-4-5-10-22-15/h4-5,9-10,14H,2-3,6-8,11-13H2,1H3,(H,23,24)/t14-,17+/m1/s1