3-azanyl-6-[2,3-bis(fluoranyl)phenyl]-1-(2-methyl-2-oxidanyl-propyl)azepan-2-one

Systemtic Name: 3-azanyl-6-[2,3-bis(fluoranyl)phenyl]-1-(2-methyl-2-oxidanyl-propyl)azepan-2-one Openeye Name: 3-amino-6-(2,3-difluorophenyl)-1-(2-hydroxy-2-methyl-propyl)azepan-2-one CAS Name: 3-amino-6-(2,3-difluorophenyl)-1-(2-hydroxy-2-methylpropyl)-2-azepanone IUPAC Name: 3-amino-6-(2,3-difluorophenyl)-1-(2-hydroxy-2-methylpropyl)azepan-2-one Traditional Name: 3-amino-6-(2,3-difluorophenyl)-1-(2-hydroxy-2-methyl-propyl)azepan-2-one Formula: C16H22F2N2O2 MolecularWeight: 312.354886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN1CC(CCC(C1=O)N)C2=C(C(=CC=C2)F)F)O

Isomeric SMILES

CC(C)(CN1CC(CCC(C1=O)N)C2=C(C(=CC=C2)F)F)O

InChI

InChI=1S/C16H22F2N2O2/c1-16(2,22)9-20-8-10(6-7-13(19)15(20)21)11-4-3-5-12(17)14(11)18/h3-5,10,13,22H,6-9,19H2,1-2H3