N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-piperonylamide Formula: C22H26N2O7S MolecularWeight: 462.51604

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)S(=O)(=O)CCCNC(=O)C3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)S(=O)(=O)CCCNC(=O)C3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C22H26N2O7S/c1-28-19-10-15-6-8-24(13-17(15)12-20(19)29-2)32(26,27)9-3-7-23-22(25)16-4-5-18-21(11-16)31-14-30-18/h4-5,10-12H,3,6-9,13-14H2,1-2H3,(H,23,25)