phenyl 4-[4,5-bis(chloranyl)-2-methyl-pyrazol-3-yl]oxybenzenesulfonate

Systemtic Name: phenyl 4-[4,5-bis(chloranyl)-2-methyl-pyrazol-3-yl]oxybenzenesulfonate Openeye Name: phenyl 4-(4,5-dichloro-2-methyl-pyrazol-3-yl)oxybenzenesulfonate CAS Name: 4-[(4,5-dichloro-2-methyl-3-pyrazolyl)oxy]benzenesulfonic acid phenyl ester IUPAC Name: phenyl 4-(4,5-dichloro-2-methylpyrazol-3-yl)oxybenzenesulfonate Traditional Name: 4-(4,5-dichloro-2-methyl-pyrazol-3-yl)oxybenzenesulfonic acid phenyl ester Formula: C16H12Cl2N2O4S MolecularWeight: 399.24848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)Cl)Cl)OC2=CC=C(C=C2)S(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

CN1C(=C(C(=N1)Cl)Cl)OC2=CC=C(C=C2)S(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C16H12Cl2N2O4S/c1-20-16(14(17)15(18)19-20)23-11-7-9-13(10-8-11)25(21,22)24-12-5-3-2-4-6-12/h2-10H,1H3