5-methyl-2-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)oxy]benzenesulfonic acid

Systemtic Name: 5-methyl-2-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)oxy]benzenesulfonic acid Openeye Name: 5-methyl-2-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)oxy]benzenesulfonic acid CAS Name: 5-methyl-2-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)oxy]benzenesulfonic acid IUPAC Name: 5-methyl-2-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)oxy]benzenesulfonic acid Traditional Name: 2-[(5-keto-3-methyl-1-phenyl-3-pyrazolin-4-yl)oxy]-5-methyl-besylic acid Formula: C17H16N2O5S MolecularWeight: 360.38434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2=C(NN(C2=O)C3=CC=CC=C3)C)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OC2=C(NN(C2=O)C3=CC=CC=C3)C)S(=O)(=O)O

InChI

InChI=1S/C17H16N2O5S/c1-11-8-9-14(15(10-11)25(21,22)23)24-16-12(2)18-19(17(16)20)13-6-4-3-5-7-13/h3-10,18H,1-2H3,(H,21,22,23)