3,9-dimethoxy-7-methyl-5,6,12,12a-tetrahydroindolo[2,1-a]isoquinolin-7-ium-2,10-diol iodide

Systemtic Name: 3,9-dimethoxy-7-methyl-5,6,12,12a-tetrahydroindolo[2,1-a]isoquinolin-7-ium-2,10-diol iodide Openeye Name: 3,9-dimethoxy-7-methyl-5,6,12,12a-tetrahydroindolo[2,1-a]isoquinolin-7-ium-2,10-diol iodide CAS Name: 3,9-dimethoxy-7-methyl-5,6,12,12a-tetrahydroindolo[2,1-a]isoquinolin-7-ium-2,10-diol iodide IUPAC Name: 3,9-dimethoxy-7-methyl-5,6,12,12a-tetrahydroindolo[2,1-a]isoquinolin-7-ium-2,10-diol iodide Traditional Name: 3,9-dimethoxy-7-methyl-5,6,12,12a-tetrahydroindol[2,1-a]isoquinolin-7-ium-2,10-diol iodide Formula: C19H22INO4 MolecularWeight: 455.28675

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]12CCC3=CC(=C(C=C3C1CC4=CC(=C(C=C24)OC)O)O)OC.[I-]

Isomeric SMILES

C[N+]12CCC3=CC(=C(C=C3C1CC4=CC(=C(C=C24)OC)O)O)OC.[I-]

InChI

InChI=1S/C19H21NO4.HI/c1-20-5-4-11-8-18(23-2)17(22)9-13(11)15(20)6-12-7-16(21)19(24-3)10-14(12)20;/h7-10,15H,4-6H2,1-3H3,(H-,21,22);1H