4-[(3-fluoranyl-4-methoxy-phenyl)methyl]-5-methyl-1,2-dihydropyrazol-3-one

Systemtic Name: 4-[(3-fluoranyl-4-methoxy-phenyl)methyl]-5-methyl-1,2-dihydropyrazol-3-one Openeye Name: 4-[(3-fluoro-4-methoxy-phenyl)methyl]-5-methyl-1,2-dihydropyrazol-3-one CAS Name: 4-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-1,2-dihydropyrazol-3-one IUPAC Name: 4-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-1,2-dihydropyrazol-3-one Traditional Name: 4-(3-fluoro-4-methoxy-benzyl)-5-methyl-3-pyrazolin-3-one Formula: C12H13FN2O2 MolecularWeight: 236.242223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN1)CC2=CC(=C(C=C2)OC)F

Isomeric SMILES

CC1=C(C(=O)NN1)CC2=CC(=C(C=C2)OC)F

InChI

InChI=1S/C12H13FN2O2/c1-7-9(12(16)15-14-7)5-8-3-4-11(17-2)10(13)6-8/h3-4,6H,5H2,1-2H3,(H2,14,15,16)