3-[(4-fluorophenyl)methylamino]azepan-2-one

Systemtic Name: 3-[(4-fluorophenyl)methylamino]azepan-2-one Openeye Name: 3-[(4-fluorophenyl)methylamino]azepan-2-one CAS Name: 3-[(4-fluorophenyl)methylamino]-2-azepanone IUPAC Name: 3-[(4-fluorophenyl)methylamino]azepan-2-one Traditional Name: 3-[(4-fluorobenzyl)amino]azepan-2-one Formula: C13H17FN2O MolecularWeight: 236.285283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NCC2=CC=C(C=C2)F

Isomeric SMILES

C1CCNC(=O)C(C1)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C13H17FN2O/c14-11-6-4-10(5-7-11)9-16-12-3-1-2-8-15-13(12)17/h4-7,12,16H,1-3,8-9H2,(H,15,17)