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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17FN2O/c14-11-5-3-4-10(8-11)9-16-12-6-1-2-7-15-13(12)17/h3-5,8,12,16H,1-2,6-7,9H2,(H,15,17)