6,7-dimethoxy-3-[6-[2-(methoxymethoxy)ethyl]-1,3-benzodioxol-5-yl]-2H-isoquinolin-1-one

Systemtic Name: 6,7-dimethoxy-3-[6-[2-(methoxymethoxy)ethyl]-1,3-benzodioxol-5-yl]-2H-isoquinolin-1-one Openeye Name: 6,7-dimethoxy-3-[6-[2-(methoxymethoxy)ethyl]-1,3-benzodioxol-5-yl]-2H-isoquinolin-1-one CAS Name: 6,7-dimethoxy-3-[6-[2-(methoxymethoxy)ethyl]-1,3-benzodioxol-5-yl]-2H-isoquinolin-1-one IUPAC Name: 6,7-dimethoxy-3-[6-[2-(methoxymethoxy)ethyl]-1,3-benzodioxol-5-yl]-2H-isoquinolin-1-one Traditional Name: 6,7-dimethoxy-3-[6-[2-(methoxymethoxy)ethyl]-1,3-benzodioxol-5-yl]isocarbostyril Formula: C22H23NO7 MolecularWeight: 413.42052

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Descriptors Computed from Structure

Canonical SMILES:

COCOCCC1=CC2=C(C=C1C3=CC4=CC(=C(C=C4C(=O)N3)OC)OC)OCO2

Isomeric SMILES

COCOCCC1=CC2=C(C=C1C3=CC4=CC(=C(C=C4C(=O)N3)OC)OC)OCO2

InChI

InChI=1S/C22H23NO7/c1-25-11-28-5-4-13-7-20-21(30-12-29-20)9-15(13)17-6-14-8-18(26-2)19(27-3)10-16(14)22(24)23-17/h6-10H,4-5,11-12H2,1-3H3,(H,23,24)