2-chloranyl-3-methyl-4-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)benzenesulfonic acid

Systemtic Name: 2-chloranyl-3-methyl-4-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)benzenesulfonic acid Openeye Name: 2-chloro-3-methyl-4-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzenesulfonic acid CAS Name: 2-chloro-3-methyl-4-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzenesulfonic acid IUPAC Name: 2-chloro-3-methyl-4-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzenesulfonic acid Traditional Name: 2-chloro-4-(5-keto-3-methyl-2-pyrazolin-1-yl)-3-methyl-besylic acid Formula: C11H11ClN2O4S MolecularWeight: 302.73404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1)C2=C(C(=C(C=C2)S(=O)(=O)O)Cl)C

Isomeric SMILES

CC1=NN(C(=O)C1)C2=C(C(=C(C=C2)S(=O)(=O)O)Cl)C

InChI

InChI=1S/C11H11ClN2O4S/c1-6-5-10(15)14(13-6)8-3-4-9(19(16,17)18)11(12)7(8)2/h3-4H,5H2,1-2H3,(H,16,17,18)