(4Z)-5-methyl-4-[1-(oxidanylamino)ethylidene]-2-(phenylmethyl)pyrazol-3-one

Systemtic Name: (4Z)-5-methyl-4-[1-(oxidanylamino)ethylidene]-2-(phenylmethyl)pyrazol-3-one Openeye Name: (4Z)-2-benzyl-4-[1-(hydroxyamino)ethylidene]-5-methyl-pyrazol-3-one CAS Name: (4Z)-4-[1-(hydroxyamino)ethylidene]-5-methyl-2-(phenylmethyl)-3-pyrazolone IUPAC Name: (4Z)-2-benzyl-4-[1-(hydroxyamino)ethylidene]-5-methylpyrazol-3-one Traditional Name: (4Z)-2-benzyl-4-[1-(hydroxyamino)ethylidene]-5-methyl-2-pyrazolin-3-one Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=C(C)NO)CC2=CC=CC=C2

Isomeric SMILES

CC\1=NN(C(=O)/C1=C(/C)\NO)CC2=CC=CC=C2

InChI

InChI=1S/C13H15N3O2/c1-9-12(10(2)15-18)13(17)16(14-9)8-11-6-4-3-5-7-11/h3-7,15,18H,8H2,1-2H3/b12-10-