[2-(3,4-dichlorophenyl)-5-propyl-pyrazol-3-yl] 4-methoxybenzenesulfonate

Systemtic Name: [2-(3,4-dichlorophenyl)-5-propyl-pyrazol-3-yl] 4-methoxybenzenesulfonate Openeye Name: [2-(3,4-dichlorophenyl)-5-propyl-pyrazol-3-yl] 4-methoxybenzenesulfonate CAS Name: 4-methoxybenzenesulfonic acid [2-(3,4-dichlorophenyl)-5-propyl-3-pyrazolyl] ester IUPAC Name: [2-(3,4-dichlorophenyl)-5-propylpyrazol-3-yl] 4-methoxybenzenesulfonate Traditional Name: 4-methoxybenzenesulfonic acid [2-(3,4-dichlorophenyl)-5-propyl-pyrazol-3-yl] ester Formula: C19H18Cl2N2O4S MolecularWeight: 441.32822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1)OS(=O)(=O)C2=CC=C(C=C2)OC)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCCC1=NN(C(=C1)OS(=O)(=O)C2=CC=C(C=C2)OC)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H18Cl2N2O4S/c1-3-4-13-11-19(23(22-13)14-5-10-17(20)18(21)12-14)27-28(24,25)16-8-6-15(26-2)7-9-16/h5-12H,3-4H2,1-2H3