6-(6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)-6-methyl-furo[3,4-g][1,3]benzodioxol-8-one chloride

Systemtic Name: 6-(6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)-6-methyl-furo[3,4-g][1,3]benzodioxol-8-one chloride Openeye Name: 6-(6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)-6-methyl-furo[3,4-g][1,3]benzodioxol-8-one chloride CAS Name: 6-(6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)-6-methyl-8-furo[3,4-g][1,3]benzodioxolone chloride IUPAC Name: 6-(6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)-6-methylfuro[3,4-g][1,3]benzodioxol-8-one chloride Traditional Name: 6-(6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxol[4,5-g]isoquinolin-6-ium-5-yl)-6-methyl-furo[3,4-g][1,3]benzodioxol-8-one chloride Formula: C22H22ClNO6 MolecularWeight: 431.86618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C3=C(C=C2)OCO3)C(=O)O1)C4C5=CC6=C(C=C5CC[N+]4(C)C)OCO6.[Cl-]

Isomeric SMILES

CC1(C2=C(C3=C(C=C2)OCO3)C(=O)O1)C4C5=CC6=C(C=C5CC[N+]4(C)C)OCO6.[Cl-]

InChI

InChI=1S/C22H22NO6.ClH/c1-22(14-4-5-15-19(28-11-25-15)18(14)21(24)29-22)20-13-9-17-16(26-10-27-17)8-12(13)6-7-23(20,2)3;/h4-5,8-9,20H,6-7,10-11H2,1-3H3;1H/q+1;/p-1