5-methyl-4-[(R)-(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)-(5-nitro-2-oxidanidyl-phenyl)methyl]-2-phenyl-pyrazol-3-olate

Systemtic Name: 5-methyl-4-[(R)-(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)-(5-nitro-2-oxidanidyl-phenyl)methyl]-2-phenyl-pyrazol-3-olate Openeye Name: 5-methyl-4-[(R)-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-(5-nitro-2-oxido-phenyl)methyl]-2-phenyl-pyrazol-3-olate CAS Name: 5-methyl-4-[(R)-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-(5-nitro-2-oxidophenyl)methyl]-2-phenyl-3-pyrazololate IUPAC Name: 5-methyl-4-[(R)-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-(5-nitro-2-oxidophenyl)methyl]-2-phenylpyrazol-3-olate Traditional Name: 4-[(R)-(5-keto-3-methyl-1-phenyl-3-pyrazolin-4-yl)-(5-nitro-2-oxido-phenyl)methyl]-5-methyl-2-phenyl-pyrazol-3-olate Formula: C27H21N5O5-2 MolecularWeight: 495.48614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C(C3=C(C=CC(=C3)[N+](=O)[O-])[O-])C4=C(N(N=C4C)C5=CC=CC=C5)[O-]

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)[C@H](C3=C(C=CC(=C3)[N+](=O)[O-])[O-])C4=C(N(N=C4C)C5=CC=CC=C5)[O-]

InChI

InChI=1S/C27H23N5O5/c1-16-23(26(34)30(28-16)18-9-5-3-6-10-18)25(21-15-20(32(36)37)13-14-22(21)33)24-17(2)29-31(27(24)35)19-11-7-4-8-12-19/h3-15,25,28,33,35H,1-2H3/p-2/t25-/m0/s1