4-nitro-2-[(5R)-5-pyridin-4-yl-4,5-dihydro-1H-pyrazol-3-yl]phenolate

Systemtic Name: 4-nitro-2-[(5R)-5-pyridin-4-yl-4,5-dihydro-1H-pyrazol-3-yl]phenolate Openeye Name: 4-nitro-2-[(5R)-5-(4-pyridyl)-4,5-dihydro-1H-pyrazol-3-yl]phenolate CAS Name: 4-nitro-2-[(5R)-5-pyridin-4-yl-4,5-dihydro-1H-pyrazol-3-yl]phenolate IUPAC Name: 4-nitro-2-[(5R)-5-pyridin-4-yl-4,5-dihydro-1H-pyrazol-3-yl]phenolate Traditional Name: 4-nitro-2-[(5R)-5-(4-pyridyl)-2-pyrazolin-3-yl]phenolate Formula: C14H11N4O3- MolecularWeight: 283.26214

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NN=C1C2=C(C=CC(=C2)[N+](=O)[O-])[O-])C3=CC=NC=C3

Isomeric SMILES

C1[C@@H](NN=C1C2=C(C=CC(=C2)[N+](=O)[O-])[O-])C3=CC=NC=C3

InChI

InChI=1S/C14H12N4O3/c19-14-2-1-10(18(20)21)7-11(14)13-8-12(16-17-13)9-3-5-15-6-4-9/h1-7,12,16,19H,8H2/p-1/t12-/m1/s1