5-chloranyl-1,3-dimethyl-pyrazole-4-sulfonic acid

Systemtic Name: 5-chloranyl-1,3-dimethyl-pyrazole-4-sulfonic acid Openeye Name: 5-chloro-1,3-dimethyl-pyrazole-4-sulfonic acid CAS Name: 5-chloro-1,3-dimethyl-4-pyrazolesulfonic acid IUPAC Name: 5-chloro-1,3-dimethylpyrazole-4-sulfonic acid Traditional Name: 5-chloro-1,3-dimethyl-pyrazole-4-sulfonic acid Formula: C5H7ClN2O3S MolecularWeight: 210.63868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1S(=O)(=O)O)Cl)C

Isomeric SMILES

CC1=NN(C(=C1S(=O)(=O)O)Cl)C

InChI

InChI=1S/C5H7ClN2O3S/c1-3-4(12(9,10)11)5(6)8(2)7-3/h1-2H3,(H,9,10,11)