[3,4-bis(fluoranyl)phenyl] 2,3-dimethyl-5-nitro-benzenesulfonate

Systemtic Name: [3,4-bis(fluoranyl)phenyl] 2,3-dimethyl-5-nitro-benzenesulfonate Openeye Name: (3,4-difluorophenyl) 2,3-dimethyl-5-nitro-benzenesulfonate CAS Name: 2,3-dimethyl-5-nitrobenzenesulfonic acid (3,4-difluorophenyl) ester IUPAC Name: (3,4-difluorophenyl) 2,3-dimethyl-5-nitrobenzenesulfonate Traditional Name: 2,3-dimethyl-5-nitro-benzenesulfonic acid (3,4-difluorophenyl) ester Formula: C14H11F2NO5S MolecularWeight: 343.302646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)OC2=CC(=C(C=C2)F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)OC2=CC(=C(C=C2)F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H11F2NO5S/c1-8-5-10(17(18)19)6-14(9(8)2)23(20,21)22-11-3-4-12(15)13(16)7-11/h3-7H,1-2H3