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

Systemtic Name: N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-4-methoxy-3-nitro-benzenesulfonamide Openeye Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-methoxy-3-nitro-benzenesulfonamide CAS Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-methoxy-3-nitrobenzenesulfonamide IUPAC Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-methoxy-3-nitrobenzenesulfonamide Traditional Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-methoxy-3-nitro-benzenesulfonamide Formula: C14H10F2N2O7S MolecularWeight: 388.300206

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)OC(O3)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)OC(O3)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H10F2N2O7S/c1-23-11-5-3-9(7-10(11)18(19)20)26(21,22)17-8-2-4-12-13(6-8)25-14(15,16)24-12/h2-7,17H,1H3