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

Systemtic Name: 4-[[(3,4-dinitrophenyl)amino]methylidene]-5-methyl-2-(4-methylphenyl)pyrazol-3-one Openeye Name: 4-[(3,4-dinitroanilino)methylene]-5-methyl-2-(p-tolyl)pyrazol-3-one CAS Name: 4-[(3,4-dinitroanilino)methylidene]-5-methyl-2-(4-methylphenyl)-3-pyrazolone IUPAC Name: 4-[(3,4-dinitroanilino)methylidene]-5-methyl-2-(4-methylphenyl)pyrazol-3-one Traditional Name: 4-[(3,4-dinitroanilino)methylene]-5-methyl-2-(p-tolyl)-2-pyrazolin-3-one Formula: C18H15N5O5 MolecularWeight: 381.3422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15N5O5/c1-11-3-6-14(7-4-11)21-18(24)15(12(2)20-21)10-19-13-5-8-16(22(25)26)17(9-13)23(27)28/h3-10,19H,1-2H3