4-chloranyl-3-[(4Z)-3-methyl-5-oxidanylidene-4-(phenylhydrazinylidene)pyrazol-1-yl]benzenesulfonic acid

Systemtic Name: 4-chloranyl-3-[(4Z)-3-methyl-5-oxidanylidene-4-(phenylhydrazinylidene)pyrazol-1-yl]benzenesulfonic acid Openeye Name: 4-chloro-3-[(4Z)-3-methyl-5-oxo-4-(phenylhydrazono)pyrazol-1-yl]benzenesulfonic acid CAS Name: 4-chloro-3-[(4Z)-3-methyl-5-oxo-4-(phenylhydrazinylidene)-1-pyrazolyl]benzenesulfonic acid IUPAC Name: 4-chloro-3-[(4Z)-3-methyl-5-oxo-4-(phenylhydrazinylidene)pyrazol-1-yl]benzenesulfonic acid Traditional Name: 4-chloro-3-[(4Z)-5-keto-3-methyl-4-(phenylhydrazono)-2-pyrazolin-1-yl]besylic acid Formula: C16H13ClN4O4S MolecularWeight: 392.81682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=NNC2=CC=CC=C2)C3=C(C=CC(=C3)S(=O)(=O)O)Cl

Isomeric SMILES

CC\1=NN(C(=O)/C1=N\NC2=CC=CC=C2)C3=C(C=CC(=C3)S(=O)(=O)O)Cl

InChI

InChI=1S/C16H13ClN4O4S/c1-10-15(19-18-11-5-3-2-4-6-11)16(22)21(20-10)14-9-12(26(23,24)25)7-8-13(14)17/h2-9,18H,1H3,(H,23,24,25)/b19-15-