2-[(1-methyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[(1-methyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)iminomethyl]-4-nitro-phenolate Openeye Name: 2-[(1-methyl-3-oxo-2-phenyl-pyrazol-4-yl)iminomethyl]-4-nitro-phenolate CAS Name: 2-[(1-methyl-3-oxo-2-phenyl-4-pyrazolyl)iminomethyl]-4-nitrophenolate IUPAC Name: 2-[(1-methyl-3-oxo-2-phenylpyrazol-4-yl)iminomethyl]-4-nitrophenolate Traditional Name: 2-[(3-keto-1-methyl-2-phenyl-3-pyrazolin-4-yl)iminomethyl]-4-nitro-phenolate Formula: C17H13N4O4- MolecularWeight: 337.30952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)N1C2=CC=CC=C2)N=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

CN1C=C(C(=O)N1C2=CC=CC=C2)N=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C17H14N4O4/c1-19-11-15(17(23)20(19)13-5-3-2-4-6-13)18-10-12-9-14(21(24)25)7-8-16(12)22/h2-11,22H,1H3/p-1