(2-nitrophenyl)methyl 4-chloranyl-2-(trifluoromethyl)benzenesulfonate

Systemtic Name: (2-nitrophenyl)methyl 4-chloranyl-2-(trifluoromethyl)benzenesulfonate Openeye Name: (2-nitrophenyl)methyl 4-chloro-2-(trifluoromethyl)benzenesulfonate CAS Name: 4-chloro-2-(trifluoromethyl)benzenesulfonic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 4-chloro-2-(trifluoromethyl)benzenesulfonate Traditional Name: 4-chloro-2-(trifluoromethyl)benzenesulfonic acid (2-nitrobenzyl) ester Formula: C14H9ClF3NO5S MolecularWeight: 395.73817

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COS(=O)(=O)C2=C(C=C(C=C2)Cl)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)COS(=O)(=O)C2=C(C=C(C=C2)Cl)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H9ClF3NO5S/c15-10-5-6-13(11(7-10)14(16,17)18)25(22,23)24-8-9-3-1-2-4-12(9)19(20)21/h1-7H,8H2