3-[[4-(trifluoromethyloxy)phenyl]amino]azepan-2-one

Systemtic Name: 3-[[4-(trifluoromethyloxy)phenyl]amino]azepan-2-one Openeye Name: 3-[4-(trifluoromethoxy)anilino]azepan-2-one CAS Name: 3-[4-(trifluoromethoxy)anilino]-2-azepanone IUPAC Name: 3-[4-(trifluoromethoxy)anilino]azepan-2-one Traditional Name: 3-[4-(trifluoromethoxy)anilino]azepan-2-one Formula: C13H15F3N2O2 MolecularWeight: 288.26561

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC2=CC=C(C=C2)OC(F)(F)F

Isomeric SMILES

C1CCNC(=O)C(C1)NC2=CC=C(C=C2)OC(F)(F)F

InChI

InChI=1S/C13H15F3N2O2/c14-13(15,16)20-10-6-4-9(5-7-10)18-11-3-1-2-8-17-12(11)19/h4-7,11,18H,1-3,8H2,(H,17,19)