1-[(2-azanyl-5-fluoranyl-phenyl)methyl]azepan-2-one

Systemtic Name: 1-[(2-azanyl-5-fluoranyl-phenyl)methyl]azepan-2-one Openeye Name: 1-[(2-amino-5-fluoro-phenyl)methyl]azepan-2-one CAS Name: 1-[(2-amino-5-fluorophenyl)methyl]-2-azepanone IUPAC Name: 1-[(2-amino-5-fluorophenyl)methyl]azepan-2-one Traditional Name: 1-(2-amino-5-fluoro-benzyl)azepan-2-one Formula: C13H17FN2O MolecularWeight: 236.285283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CC2=C(C=CC(=C2)F)N

Isomeric SMILES

C1CCC(=O)N(CC1)CC2=C(C=CC(=C2)F)N

InChI

InChI=1S/C13H17FN2O/c14-11-5-6-12(15)10(8-11)9-16-7-3-1-2-4-13(16)17/h5-6,8H,1-4,7,9,15H2