N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-3-chloranyl-4-methyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-3-chloranyl-4-methyl-5-nitro-benzenesulfonamide Openeye Name: 3-chloro-N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-methyl-5-nitro-benzenesulfonamide CAS Name: 3-chloro-N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-methyl-5-nitrobenzenesulfonamide IUPAC Name: 3-chloro-N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-methyl-5-nitrobenzenesulfonamide Traditional Name: 3-chloro-N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-methyl-5-nitro-benzenesulfonamide Formula: C14H9ClF2N2O6S MolecularWeight: 406.745866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NC2=CC3=C(C=C2)OC(O3)(F)F)Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NC2=CC3=C(C=C2)OC(O3)(F)F)Cl

InChI

InChI=1S/C14H9ClF2N2O6S/c1-7-10(15)5-9(6-11(7)19(20)21)26(22,23)18-8-2-3-12-13(4-8)25-14(16,17)24-12/h2-6,18H,1H3