7-[[3-(trifluoromethyl)-1,2-oxazol-4-yl]methyl]azepan-3-one

Systemtic Name: 7-[[3-(trifluoromethyl)-1,2-oxazol-4-yl]methyl]azepan-3-one Openeye Name: 7-[[3-(trifluoromethyl)isoxazol-4-yl]methyl]azepan-3-one CAS Name: 7-[[3-(trifluoromethyl)-4-isoxazolyl]methyl]-3-azepanone IUPAC Name: 7-[[3-(trifluoromethyl)-1,2-oxazol-4-yl]methyl]azepan-3-one Traditional Name: 7-[[3-(trifluoromethyl)isoxazol-4-yl]methyl]azepan-3-one Formula: C11H13F3N2O2 MolecularWeight: 262.22833

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NCC(=O)C1)CC2=CON=C2C(F)(F)F

Isomeric SMILES

C1CC(NCC(=O)C1)CC2=CON=C2C(F)(F)F

InChI

InChI=1S/C11H13F3N2O2/c12-11(13,14)10-7(6-18-16-10)4-8-2-1-3-9(17)5-15-8/h6,8,15H,1-5H2