3-[1-[2,4-bis(fluoranyl)phenyl]ethylamino]azepan-2-one

Systemtic Name: 3-[1-[2,4-bis(fluoranyl)phenyl]ethylamino]azepan-2-one Openeye Name: 3-[1-(2,4-difluorophenyl)ethylamino]azepan-2-one CAS Name: 3-[1-(2,4-difluorophenyl)ethylamino]-2-azepanone IUPAC Name: 3-[1-(2,4-difluorophenyl)ethylamino]azepan-2-one Traditional Name: 3-[1-(2,4-difluorophenyl)ethylamino]azepan-2-one Formula: C14H18F2N2O MolecularWeight: 268.302326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)F)F)NC2CCCCNC2=O

Isomeric SMILES

CC(C1=C(C=C(C=C1)F)F)NC2CCCCNC2=O

InChI

InChI=1S/C14H18F2N2O/c1-9(11-6-5-10(15)8-12(11)16)18-13-4-2-3-7-17-14(13)19/h5-6,8-9,13,18H,2-4,7H2,1H3,(H,17,19)