3-methyl-N-[(E)-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-methyl-N-[(E)-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-methyl-N-[(E)-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-methyl-N-[(E)-[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]methylideneamino]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-methyl-N-[(E)-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]methylideneamino]-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[(E)-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]phthalazine-1-carboxamide Formula: C26H19N7O4 MolecularWeight: 493.47356

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CN(N=C3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C/C3=CN(N=C3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C26H19N7O4/c1-31-26(35)22-10-6-5-9-21(22)24(29-31)25(34)28-27-15-18-16-32(19-7-3-2-4-8-19)30-23(18)17-11-13-20(14-12-17)33(36)37/h2-16H,1H3,(H,28,34)/b27-15+