2-methoxy-5-(5-methyl-3-oxidanylidene-1H-pyrazol-2-yl)benzenesulfonic acid

Systemtic Name: 2-methoxy-5-(5-methyl-3-oxidanylidene-1H-pyrazol-2-yl)benzenesulfonic acid Openeye Name: 2-methoxy-5-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid CAS Name: 2-methoxy-5-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid IUPAC Name: 2-methoxy-5-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid Traditional Name: 5-(5-keto-3-methyl-3-pyrazolin-1-yl)-2-methoxy-besylic acid Formula: C11H12N2O5S MolecularWeight: 284.28838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(N1)C2=CC(=C(C=C2)OC)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=O)N(N1)C2=CC(=C(C=C2)OC)S(=O)(=O)O

InChI

InChI=1S/C11H12N2O5S/c1-7-5-11(14)13(12-7)8-3-4-9(18-2)10(6-8)19(15,16)17/h3-6,12H,1-2H3,(H,15,16,17)