3-[[2-(trifluoromethyl)phenyl]methylamino]azepan-2-one

Systemtic Name: 3-[[2-(trifluoromethyl)phenyl]methylamino]azepan-2-one Openeye Name: 3-[[2-(trifluoromethyl)phenyl]methylamino]azepan-2-one CAS Name: 3-[[2-(trifluoromethyl)phenyl]methylamino]-2-azepanone IUPAC Name: 3-[[2-(trifluoromethyl)phenyl]methylamino]azepan-2-one Traditional Name: 3-[[2-(trifluoromethyl)benzyl]amino]azepan-2-one Formula: C14H17F3N2O MolecularWeight: 286.29279

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NCC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

C1CCNC(=O)C(C1)NCC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C14H17F3N2O/c15-14(16,17)11-6-2-1-5-10(11)9-19-12-7-3-4-8-18-13(12)20/h1-2,5-6,12,19H,3-4,7-9H2,(H,18,20)