(4Z)-4-[(4-dimethylaminophenyl)methylidene]-2-[4-(dioxidanylmethyl)phenyl]-5-methyl-pyrazol-3-one

Systemtic Name: (4Z)-4-[(4-dimethylaminophenyl)methylidene]-2-[4-(dioxidanylmethyl)phenyl]-5-methyl-pyrazol-3-one Openeye Name: (4Z)-4-[(4-dimethylaminophenyl)methylene]-2-[4-(hydroperoxymethyl)phenyl]-5-methyl-pyrazol-3-one CAS Name: (4Z)-4-[(4-dimethylaminophenyl)methylidene]-2-[4-(hydroperoxymethyl)phenyl]-5-methyl-3-pyrazolone IUPAC Name: (4Z)-4-[(4-dimethylaminophenyl)methylidene]-2-[4-(hydroperoxymethyl)phenyl]-5-methylpyrazol-3-one Traditional Name: (4Z)-4-[4-(dimethylamino)benzylidene]-2-[4-(hydroperoxymethyl)phenyl]-5-methyl-2-pyrazolin-3-one Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)COO

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)COO

InChI

InChI=1S/C20H21N3O3/c1-14-19(12-15-4-8-17(9-5-15)22(2)3)20(24)23(21-14)18-10-6-16(7-11-18)13-26-25/h4-12,25H,13H2,1-3H3/b19-12-