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

Systemtic Name: 4-[[(3,4-dinitrophenyl)amino]methylidene]-2-(4-methoxyphenyl)-5-methyl-pyrazol-3-one Openeye Name: 4-[(3,4-dinitroanilino)methylene]-2-(4-methoxyphenyl)-5-methyl-pyrazol-3-one CAS Name: 4-[(3,4-dinitroanilino)methylidene]-2-(4-methoxyphenyl)-5-methyl-3-pyrazolone IUPAC Name: 4-[(3,4-dinitroanilino)methylidene]-2-(4-methoxyphenyl)-5-methylpyrazol-3-one Traditional Name: 4-[(3,4-dinitroanilino)methylene]-2-(4-methoxyphenyl)-5-methyl-2-pyrazolin-3-one Formula: C18H15N5O6 MolecularWeight: 397.3416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNC2=CC(=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=NN(C(=O)C1=CNC2=CC(=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H15N5O6/c1-11-15(18(24)21(20-11)13-4-6-14(29-2)7-5-13)10-19-12-3-8-16(22(25)26)17(9-12)23(27)28/h3-10,19H,1-2H3