3-azanyl-6-[2,3-bis(fluoranyl)phenyl]-1-pyridin-4-yl-azepan-2-one

Systemtic Name: 3-azanyl-6-[2,3-bis(fluoranyl)phenyl]-1-pyridin-4-yl-azepan-2-one Openeye Name: 3-amino-6-(2,3-difluorophenyl)-1-(4-pyridyl)azepan-2-one CAS Name: 3-amino-6-(2,3-difluorophenyl)-1-pyridin-4-yl-2-azepanone IUPAC Name: 3-amino-6-(2,3-difluorophenyl)-1-pyridin-4-ylazepan-2-one Traditional Name: 3-amino-6-(2,3-difluorophenyl)-1-(4-pyridyl)azepan-2-one Formula: C17H17F2N3O MolecularWeight: 317.333186

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)N(CC1C2=C(C(=CC=C2)F)F)C3=CC=NC=C3)N

Isomeric SMILES

C1CC(C(=O)N(CC1C2=C(C(=CC=C2)F)F)C3=CC=NC=C3)N

InChI

InChI=1S/C17H17F2N3O/c18-14-3-1-2-13(16(14)19)11-4-5-15(20)17(23)22(10-11)12-6-8-21-9-7-12/h1-3,6-9,11,15H,4-5,10,20H2