N1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N3,N3-dimethyl-benzene-1,3-disulfonamide

Systemtic Name: N1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N3,N3-dimethyl-benzene-1,3-disulfonamide Openeye Name: N1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N3,N3-dimethyl-benzene-1,3-disulfonamide CAS Name: N1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N3,N3-dimethylbenzene-1,3-disulfonamide IUPAC Name: 1-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-N,3-N-dimethylbenzene-1,3-disulfonamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N',N'-dimethyl-benzene-1,3-disulfonamide Formula: C17H20N2O6S2 MolecularWeight: 412.4805

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)S(=O)(=O)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)S(=O)(=O)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C17H20N2O6S2/c1-19(2)27(22,23)15-6-3-5-14(12-15)26(20,21)18-13-7-8-16-17(11-13)25-10-4-9-24-16/h3,5-8,11-12,18H,4,9-10H2,1-2H3