sodium 2-[4-(4-chlorophenyl)-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl]-5-methyl-pyrazol-3-olate

Systemtic Name: sodium 2-[4-(4-chlorophenyl)-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl]-5-methyl-pyrazol-3-olate Openeye Name: sodium 2-[4-(4-chlorophenyl)-6-oxo-4,5-dihydro-1H-pyridazin-3-yl]-5-methyl-pyrazol-3-olate CAS Name: sodium 2-[4-(4-chlorophenyl)-6-oxo-4,5-dihydro-1H-pyridazin-3-yl]-5-methyl-3-pyrazololate IUPAC Name: sodium 2-[4-(4-chlorophenyl)-6-oxo-4,5-dihydro-1H-pyridazin-3-yl]-5-methylpyrazol-3-olate Traditional Name: sodium 2-[4-(4-chlorophenyl)-6-keto-4,5-dihydro-1H-pyridazin-3-yl]-5-methyl-pyrazol-3-olate Formula: C14H12ClN4NaO2 MolecularWeight: 326.71345

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)[O-])C2=NNC(=O)CC2C3=CC=C(C=C3)Cl.[Na+]

Isomeric SMILES

CC1=NN(C(=C1)[O-])C2=NNC(=O)CC2C3=CC=C(C=C3)Cl.[Na+]

InChI

InChI=1S/C14H13ClN4O2.Na/c1-8-6-13(21)19(18-8)14-11(7-12(20)16-17-14)9-2-4-10(15)5-3-9;/h2-6,11,21H,7H2,1H3,(H,16,20);/q;+1/p-1