5-azanyl-2-[1-[3,4-bis(fluoranyl)phenyl]ethyl]-1H-pyrazol-3-one

Systemtic Name: 5-azanyl-2-[1-[3,4-bis(fluoranyl)phenyl]ethyl]-1H-pyrazol-3-one Openeye Name: 5-amino-2-[1-(3,4-difluorophenyl)ethyl]-1H-pyrazol-3-one CAS Name: 5-amino-2-[1-(3,4-difluorophenyl)ethyl]-1H-pyrazol-3-one IUPAC Name: 5-amino-2-[1-(3,4-difluorophenyl)ethyl]-1H-pyrazol-3-one Traditional Name: 5-amino-2-[1-(3,4-difluorophenyl)ethyl]-3-pyrazolin-3-one Formula: C11H11F2N3O MolecularWeight: 239.221346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)F)F)N2C(=O)C=C(N2)N

Isomeric SMILES

CC(C1=CC(=C(C=C1)F)F)N2C(=O)C=C(N2)N

InChI

InChI=1S/C11H11F2N3O/c1-6(16-11(17)5-10(14)15-16)7-2-3-8(12)9(13)4-7/h2-6,15H,14H2,1H3