(4-chlorophenyl) 1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]pyrrole-2-sulfonate

Systemtic Name: (4-chlorophenyl) 1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]pyrrole-2-sulfonate Openeye Name: (4-chlorophenyl) 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]pyrrole-2-sulfonate CAS Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-pyrrolesulfonic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]pyrrole-2-sulfonate Traditional Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]pyrrole-2-sulfonic acid (4-chlorophenyl) ester Formula: C16H9Cl2F3N2O3S MolecularWeight: 437.22047

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=C1)S(=O)(=O)OC2=CC=C(C=C2)Cl)C3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

C1=CN(C(=C1)S(=O)(=O)OC2=CC=C(C=C2)Cl)C3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C16H9Cl2F3N2O3S/c17-11-3-5-12(6-4-11)26-27(24,25)14-2-1-7-23(14)15-13(18)8-10(9-22-15)16(19,20)21/h1-9H