3,10-dimethoxy-6-methyl-isoquinolino[3,2-a]isoquinolin-7-ium-2,9-diol bromide

Systemtic Name: 3,10-dimethoxy-6-methyl-isoquinolino[3,2-a]isoquinolin-7-ium-2,9-diol bromide Openeye Name: 3,10-dimethoxy-6-methyl-isoquinolino[3,2-a]isoquinolin-7-ium-2,9-diol bromide CAS Name: 3,10-dimethoxy-6-methylisoquinolino[3,2-a]isoquinolin-7-ium-2,9-diol bromide IUPAC Name: 3,10-dimethoxy-6-methylisoquinolino[3,2-a]isoquinolin-7-ium-2,9-diol bromide Traditional Name: 3,10-dimethoxy-6-methyl-isoquinolin[3,2-a]isoquinolin-7-ium-2,9-diol bromide Formula: C20H18BrNO4 MolecularWeight: 416.26522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(C=C2C3=[N+]1C=C4C(=C3)C=CC(=C4O)OC)O)OC.[Br-]

Isomeric SMILES

CC1=CC2=CC(=C(C=C2C3=[N+]1C=C4C(=C3)C=CC(=C4O)OC)O)OC.[Br-]

InChI

InChI=1S/C20H17NO4.BrH/c1-11-6-13-8-19(25-3)17(22)9-14(13)16-7-12-4-5-18(24-2)20(23)15(12)10-21(11)16;/h4-10,22H,1-3H3;1H