5-methyl-4-[(3-methyl-5-oxidanidyl-1-phenyl-pyrazol-4-yl)-(3-nitrophenyl)methyl]-2-phenyl-pyrazol-3-olate

Systemtic Name: 5-methyl-4-[(3-methyl-5-oxidanidyl-1-phenyl-pyrazol-4-yl)-(3-nitrophenyl)methyl]-2-phenyl-pyrazol-3-olate Openeye Name: 5-methyl-4-[(3-methyl-5-oxido-1-phenyl-pyrazol-4-yl)-(3-nitrophenyl)methyl]-2-phenyl-pyrazol-3-olate CAS Name: 5-methyl-4-[(3-methyl-5-oxido-1-phenyl-4-pyrazolyl)-(3-nitrophenyl)methyl]-2-phenyl-3-pyrazololate IUPAC Name: 5-methyl-4-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)-(3-nitrophenyl)methyl]-2-phenylpyrazol-3-olate Traditional Name: 5-methyl-4-[(3-methyl-5-oxido-1-phenyl-pyrazol-4-yl)-(3-nitrophenyl)methyl]-2-phenyl-pyrazol-3-olate Formula: C27H21N5O4-2 MolecularWeight: 479.48674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(C2=CC(=CC=C2)[N+](=O)[O-])C3=C(N(N=C3C)C4=CC=CC=C4)[O-])[O-])C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1C(C2=CC(=CC=C2)[N+](=O)[O-])C3=C(N(N=C3C)C4=CC=CC=C4)[O-])[O-])C5=CC=CC=C5

InChI

InChI=1S/C27H23N5O4/c1-17-23(26(33)30(28-17)20-11-5-3-6-12-20)25(19-10-9-15-22(16-19)32(35)36)24-18(2)29-31(27(24)34)21-13-7-4-8-14-21/h3-16,25,33-34H,1-2H3/p-2