2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4)OC

InChI

InChI=1S/C20H23NO6S/c1-24-18-10-14-6-7-21(13-15(14)11-19(18)25-2)28(22,23)16-4-5-17-20(12-16)27-9-3-8-26-17/h4-5,10-12H,3,6-9,13H2,1-2H3