1-[3-[[3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]propyl]azepan-2-one

Systemtic Name: 1-[3-[[3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]propyl]azepan-2-one Openeye Name: 1-[3-[[3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]propyl]azepan-2-one CAS Name: 1-[3-[[3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]propyl]-2-azepanone IUPAC Name: 1-[3-[[3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]propyl]azepan-2-one Traditional Name: 1-[3-[3-(trifluoromethyl)indoxazen-6-yl]oxypropyl]azepan-2-one Formula: C17H19F3N2O3 MolecularWeight: 356.33957

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCOC2=CC3=C(C=C2)C(=NO3)C(F)(F)F

Isomeric SMILES

C1CCC(=O)N(CC1)CCCOC2=CC3=C(C=C2)C(=NO3)C(F)(F)F

InChI

InChI=1S/C17H19F3N2O3/c18-17(19,20)16-13-7-6-12(11-14(13)25-21-16)24-10-4-9-22-8-3-1-2-5-15(22)23/h6-7,11H,1-5,8-10H2