4-[[1-[4-(ethanoylsulfamoyl)phenyl]-3-methyl-5-oxidanylidene-4H-pyrazol-4-yl]diazenyl]benzoic acid

Systemtic Name: 4-[[1-[4-(ethanoylsulfamoyl)phenyl]-3-methyl-5-oxidanylidene-4H-pyrazol-4-yl]diazenyl]benzoic acid Openeye Name: 4-[[1-[4-(acetylsulfamoyl)phenyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]azo]benzoic acid CAS Name: 4-[[1-[4-(acetylsulfamoyl)phenyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]azo]benzoic acid IUPAC Name: 4-[[1-[4-(acetylsulfamoyl)phenyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid Traditional Name: 4-[[1-[4-(acetylsulfamoyl)phenyl]-5-keto-3-methyl-2-pyrazolin-4-yl]azo]benzoic acid Formula: C19H17N5O6S MolecularWeight: 443.43318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)S(=O)(=O)NC(=O)C

Isomeric SMILES

CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)S(=O)(=O)NC(=O)C

InChI

InChI=1S/C19H17N5O6S/c1-11-17(21-20-14-5-3-13(4-6-14)19(27)28)18(26)24(22-11)15-7-9-16(10-8-15)31(29,30)23-12(2)25/h3-10,17H,1-2H3,(H,23,25)(H,27,28)