5-chloranyl-3-methyl-1-phenyl-pyrazole-4-sulfonate

Systemtic Name: 5-chloranyl-3-methyl-1-phenyl-pyrazole-4-sulfonate Openeye Name: 5-chloro-3-methyl-1-phenyl-pyrazole-4-sulfonate CAS Name: 5-chloro-3-methyl-1-phenyl-4-pyrazolesulfonate IUPAC Name: 5-chloro-3-methyl-1-phenylpyrazole-4-sulfonate Traditional Name: 5-chloro-3-methyl-1-phenyl-pyrazole-4-sulfonate Formula: C10H8ClN2O3S- MolecularWeight: 271.70012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1S(=O)(=O)[O-])Cl)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1S(=O)(=O)[O-])Cl)C2=CC=CC=C2

InChI

InChI=1S/C10H9ClN2O3S/c1-7-9(17(14,15)16)10(11)13(12-7)8-5-3-2-4-6-8/h2-6H,1H3,(H,14,15,16)/p-1