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

Systemtic Name: (4Z)-4-[[(3,5-dinitrophenyl)amino]methylidene]-5-methyl-2-(4-methylphenyl)pyrazol-3-one Openeye Name: (4Z)-4-[(3,5-dinitroanilino)methylene]-5-methyl-2-(p-tolyl)pyrazol-3-one CAS Name: (4Z)-4-[(3,5-dinitroanilino)methylidene]-5-methyl-2-(4-methylphenyl)-3-pyrazolone IUPAC Name: (4Z)-4-[(3,5-dinitroanilino)methylidene]-5-methyl-2-(4-methylphenyl)pyrazol-3-one Traditional Name: (4Z)-4-[(3,5-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(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C(=N2)C

Isomeric SMILES

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

InChI

InChI=1S/C18H15N5O5/c1-11-3-5-14(6-4-11)21-18(24)17(12(2)20-21)10-19-13-7-15(22(25)26)9-16(8-13)23(27)28/h3-10,19H,1-2H3/b17-10-