5-[4-[(4-methoxyphenyl)diazenyl]-3-methyl-5-oxidanylidene-4H-pyrazol-1-yl]-2-phenoxy-benzenesulfonic acid

Systemtic Name: 5-[4-[(4-methoxyphenyl)diazenyl]-3-methyl-5-oxidanylidene-4H-pyrazol-1-yl]-2-phenoxy-benzenesulfonic acid Openeye Name: 5-[4-(4-methoxyphenyl)azo-3-methyl-5-oxo-4H-pyrazol-1-yl]-2-phenoxy-benzenesulfonic acid CAS Name: 5-[4-(4-methoxyphenyl)azo-3-methyl-5-oxo-4H-pyrazol-1-yl]-2-phenoxybenzenesulfonic acid IUPAC Name: 5-[4-[(4-methoxyphenyl)diazenyl]-3-methyl-5-oxo-4H-pyrazol-1-yl]-2-phenoxybenzenesulfonic acid Traditional Name: 5-[5-keto-4-(4-methoxyphenyl)azo-3-methyl-2-pyrazolin-1-yl]-2-phenoxy-besylic acid Formula: C23H20N4O6S MolecularWeight: 480.4931

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)OC)C3=CC(=C(C=C3)OC4=CC=CC=C4)S(=O)(=O)O

Isomeric SMILES

CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)OC)C3=CC(=C(C=C3)OC4=CC=CC=C4)S(=O)(=O)O

InChI

InChI=1S/C23H20N4O6S/c1-15-22(25-24-16-8-11-18(32-2)12-9-16)23(28)27(26-15)17-10-13-20(21(14-17)34(29,30)31)33-19-6-4-3-5-7-19/h3-14,22H,1-2H3,(H,29,30,31)