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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)NC(C1)CC2=CON=C2C(F)(F)F

Isomeric SMILES

C1CCC(=O)NC(C1)CC2=CON=C2C(F)(F)F

InChI

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