[2-(3-chlorophenyl)-5-propan-2-yl-pyrazol-3-yl] 2,5-bis(chloranyl)benzenesulfonate

Systemtic Name: [2-(3-chlorophenyl)-5-propan-2-yl-pyrazol-3-yl] 2,5-bis(chloranyl)benzenesulfonate Openeye Name: [2-(3-chlorophenyl)-5-isopropyl-pyrazol-3-yl] 2,5-dichlorobenzenesulfonate CAS Name: 2,5-dichlorobenzenesulfonic acid [2-(3-chlorophenyl)-5-propan-2-yl-3-pyrazolyl] ester IUPAC Name: [2-(3-chlorophenyl)-5-propan-2-ylpyrazol-3-yl] 2,5-dichlorobenzenesulfonate Traditional Name: 2,5-dichlorobenzenesulfonic acid [2-(3-chlorophenyl)-5-isopropyl-pyrazol-3-yl] ester Formula: C18H15Cl3N2O3S MolecularWeight: 445.7473

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15Cl3N2O3S/c1-11(2)16-10-18(23(22-16)14-5-3-4-12(19)8-14)26-27(24,25)17-9-13(20)6-7-15(17)21/h3-11H,1-2H3