N1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-N4,N4-dimethyl-2-nitro-benzene-1,4-disulfonamide

Systemtic Name: N1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-N4,N4-dimethyl-2-nitro-benzene-1,4-disulfonamide Openeye Name: N1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-N4,N4-dimethyl-2-nitro-benzene-1,4-disulfonamide CAS Name: N1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-N4,N4-dimethyl-2-nitrobenzene-1,4-disulfonamide IUPAC Name: 1-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-N,4-N-dimethyl-2-nitrobenzene-1,4-disulfonamide Traditional Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-N',N'-dimethyl-2-nitro-benzene-1,4-disulfonamide Formula: C18H21N3O8S2 MolecularWeight: 471.50464

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)S(=O)(=O)NCCC2=CC3=C(C=C2)OCCO3)[N+](=O)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)S(=O)(=O)NCCC2=CC3=C(C=C2)OCCO3)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O8S2/c1-20(2)31(26,27)14-4-6-18(15(12-14)21(22)23)30(24,25)19-8-7-13-3-5-16-17(11-13)29-10-9-28-16/h3-6,11-12,19H,7-10H2,1-2H3