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

Systemtic Name: (4E)-2-(3,4-dimethylphenyl)-5-methyl-4-[[(4-methyl-2-nitro-phenyl)amino]methylidene]pyrazol-3-one Openeye Name: (4E)-2-(3,4-dimethylphenyl)-5-methyl-4-[(4-methyl-2-nitro-anilino)methylene]pyrazol-3-one CAS Name: (4E)-2-(3,4-dimethylphenyl)-5-methyl-4-[(4-methyl-2-nitroanilino)methylidene]-3-pyrazolone IUPAC Name: (4E)-2-(3,4-dimethylphenyl)-5-methyl-4-[(4-methyl-2-nitroanilino)methylidene]pyrazol-3-one Traditional Name: (4E)-2-(3,4-dimethylphenyl)-5-methyl-4-[(4-methyl-2-nitro-anilino)methylene]-2-pyrazolin-3-one Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC=C2C(=NN(C2=O)C3=CC(=C(C=C3)C)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)N/C=C/2\C(=NN(C2=O)C3=CC(=C(C=C3)C)C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O3/c1-12-5-8-18(19(9-12)24(26)27)21-11-17-15(4)22-23(20(17)25)16-7-6-13(2)14(3)10-16/h5-11,21H,1-4H3/b17-11+