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

Systemtic Name: N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-methyl-3-nitro-benzenesulfonamide Formula: C14H10F2N2O6S MolecularWeight: 372.300806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10F2N2O6S/c1-8-2-4-10(7-11(8)18(19)20)25(21,22)17-9-3-5-12-13(6-9)24-14(15,16)23-12/h2-7,17H,1H3