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

Systemtic Name: 2-(3,4-dimethylphenyl)-4-[[(3,4-dinitrophenyl)amino]methylidene]-5-methyl-pyrazol-3-one Openeye Name: 2-(3,4-dimethylphenyl)-4-[(3,4-dinitroanilino)methylene]-5-methyl-pyrazol-3-one CAS Name: 2-(3,4-dimethylphenyl)-4-[(3,4-dinitroanilino)methylidene]-5-methyl-3-pyrazolone IUPAC Name: 2-(3,4-dimethylphenyl)-4-[(3,4-dinitroanilino)methylidene]-5-methylpyrazol-3-one Traditional Name: 2-(3,4-dimethylphenyl)-4-[(3,4-dinitroanilino)methylene]-5-methyl-2-pyrazolin-3-one Formula: C19H17N5O5 MolecularWeight: 395.36878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17N5O5/c1-11-4-6-15(8-12(11)2)22-19(25)16(13(3)21-22)10-20-14-5-7-17(23(26)27)18(9-14)24(28)29/h4-10,20H,1-3H3