(4E)-2-(4-fluorophenyl)-5-methyl-4-[1-(3-oxidanylpropylamino)ethylidene]pyrazol-3-one

Systemtic Name: (4E)-2-(4-fluorophenyl)-5-methyl-4-[1-(3-oxidanylpropylamino)ethylidene]pyrazol-3-one Openeye Name: (4E)-2-(4-fluorophenyl)-4-[1-(3-hydroxypropylamino)ethylidene]-5-methyl-pyrazol-3-one CAS Name: (4E)-2-(4-fluorophenyl)-4-[1-(3-hydroxypropylamino)ethylidene]-5-methyl-3-pyrazolone IUPAC Name: (4E)-2-(4-fluorophenyl)-4-[1-(3-hydroxypropylamino)ethylidene]-5-methylpyrazol-3-one Traditional Name: (4E)-2-(4-fluorophenyl)-4-[1-(3-hydroxypropylamino)ethylidene]-5-methyl-2-pyrazolin-3-one Formula: C15H18FN3O2 MolecularWeight: 291.320723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=C(C)NCCCO)C2=CC=C(C=C2)F

Isomeric SMILES

CC\1=NN(C(=O)/C1=C(\C)/NCCCO)C2=CC=C(C=C2)F

InChI

InChI=1S/C15H18FN3O2/c1-10(17-8-3-9-20)14-11(2)18-19(15(14)21)13-6-4-12(16)5-7-13/h4-7,17,20H,3,8-9H2,1-2H3/b14-10+