(4E)-2-(3,4-dimethylphenyl)-5-methyl-4-[[(5-nitro-2-oxidanyl-phenyl)amino]methylidene]pyrazol-3-one

Systemtic Name: (4E)-2-(3,4-dimethylphenyl)-5-methyl-4-[[(5-nitro-2-oxidanyl-phenyl)amino]methylidene]pyrazol-3-one Openeye Name: (4E)-2-(3,4-dimethylphenyl)-4-[(2-hydroxy-5-nitro-anilino)methylene]-5-methyl-pyrazol-3-one CAS Name: (4E)-2-(3,4-dimethylphenyl)-4-[(2-hydroxy-5-nitroanilino)methylidene]-5-methyl-3-pyrazolone IUPAC Name: (4E)-2-(3,4-dimethylphenyl)-4-[(2-hydroxy-5-nitroanilino)methylidene]-5-methylpyrazol-3-one Traditional Name: (4E)-2-(3,4-dimethylphenyl)-4-[(2-hydroxy-5-nitro-anilino)methylene]-5-methyl-2-pyrazolin-3-one Formula: C19H18N4O4 MolecularWeight: 366.37062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=CNC3=C(C=CC(=C3)[N+](=O)[O-])O)C(=N2)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)/C(=C/NC3=C(C=CC(=C3)[N+](=O)[O-])O)/C(=N2)C)C

InChI

InChI=1S/C19H18N4O4/c1-11-4-5-14(8-12(11)2)22-19(25)16(13(3)21-22)10-20-17-9-15(23(26)27)6-7-18(17)24/h4-10,20,24H,1-3H3/b16-10+