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

Systemtic Name: N3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)benzene-1,3-disulfonamide Openeye Name: N3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)benzene-1,3-disulfonamide CAS Name: N3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)benzene-1,3-disulfonamide IUPAC Name: 3-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)benzene-1,3-disulfonamide Traditional Name: N'-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)benzene-1,3-disulfonamide Formula: C15H16N2O6S2 MolecularWeight: 384.42734

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)N)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)N)OC1

InChI

InChI=1S/C15H16N2O6S2/c16-24(18,19)12-3-1-4-13(10-12)25(20,21)17-11-5-6-14-15(9-11)23-8-2-7-22-14/h1,3-6,9-10,17H,2,7-8H2,(H2,16,18,19)