sodium 3-methyl-4-oxidanyl-5-oxidanylidene-1-phenyl-pyrazole-4-sulfonate

Systemtic Name: sodium 3-methyl-4-oxidanyl-5-oxidanylidene-1-phenyl-pyrazole-4-sulfonate Openeye Name: sodium 4-hydroxy-3-methyl-5-oxo-1-phenyl-pyrazole-4-sulfonate CAS Name: sodium 4-hydroxy-3-methyl-5-oxo-1-phenyl-4-pyrazolesulfonate IUPAC Name: sodium 4-hydroxy-3-methyl-5-oxo-1-phenylpyrazole-4-sulfonate Traditional Name: sodium 4-hydroxy-5-keto-3-methyl-1-phenyl-2-pyrazoline-4-sulfonate Formula: C10H9N2NaO5S MolecularWeight: 292.24363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1(O)S(=O)(=O)[O-])C2=CC=CC=C2.[Na+]

Isomeric SMILES

CC1=NN(C(=O)C1(O)S(=O)(=O)[O-])C2=CC=CC=C2.[Na+]

InChI

InChI=1S/C10H10N2O5S.Na/c1-7-10(14,18(15,16)17)9(13)12(11-7)8-5-3-2-4-6-8;/h2-6,14H,1H3,(H,15,16,17);/q;+1/p-1