(2,4-dinitrophenyl)methyl 4-(trifluoromethyl)benzenesulfonate

Systemtic Name: (2,4-dinitrophenyl)methyl 4-(trifluoromethyl)benzenesulfonate Openeye Name: (2,4-dinitrophenyl)methyl 4-(trifluoromethyl)benzenesulfonate CAS Name: 4-(trifluoromethyl)benzenesulfonic acid (2,4-dinitrophenyl)methyl ester IUPAC Name: (2,4-dinitrophenyl)methyl 4-(trifluoromethyl)benzenesulfonate Traditional Name: 4-(trifluoromethyl)benzenesulfonic acid (2,4-dinitrobenzyl) ester Formula: C14H9F3N2O7S MolecularWeight: 406.29067

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(F)(F)F)S(=O)(=O)OCC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(F)(F)F)S(=O)(=O)OCC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H9F3N2O7S/c15-14(16,17)10-2-5-12(6-3-10)27(24,25)26-8-9-1-4-11(18(20)21)7-13(9)19(22)23/h1-7H,8H2