(2-bromanyl-3,4-dimethoxy-phenyl)-(6,7-dimethoxy-2-propyl-3,4-dihydroisoquinolin-2-ium-1-yl)methanone iodide

Systemtic Name: (2-bromanyl-3,4-dimethoxy-phenyl)-(6,7-dimethoxy-2-propyl-3,4-dihydroisoquinolin-2-ium-1-yl)methanone iodide Openeye Name: (2-bromo-3,4-dimethoxy-phenyl)-(6,7-dimethoxy-2-propyl-3,4-dihydroisoquinolin-2-ium-1-yl)methanone iodide CAS Name: (2-bromo-3,4-dimethoxyphenyl)-(6,7-dimethoxy-2-propyl-3,4-dihydroisoquinolin-2-ium-1-yl)methanone iodide IUPAC Name: (2-bromo-3,4-dimethoxyphenyl)-(6,7-dimethoxy-2-propyl-3,4-dihydroisoquinolin-2-ium-1-yl)methanone iodide Traditional Name: (2-bromo-3,4-dimethoxy-phenyl)-(6,7-dimethoxy-2-propyl-3,4-dihydroisoquinolin-2-ium-1-yl)methanone iodide Formula: C23H27BrINO5 MolecularWeight: 604.27265

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=C(C2=CC(=C(C=C2CC1)OC)OC)C(=O)C3=C(C(=C(C=C3)OC)OC)Br.[I-]

Isomeric SMILES

CCC[N+]1=C(C2=CC(=C(C=C2CC1)OC)OC)C(=O)C3=C(C(=C(C=C3)OC)OC)Br.[I-]

InChI

InChI=1S/C23H27BrNO5.HI/c1-6-10-25-11-9-14-12-18(28-3)19(29-4)13-16(14)21(25)22(26)15-7-8-17(27-2)23(30-5)20(15)24;/h7-8,12-13H,6,9-11H2,1-5H3;1H/q+1;/p-1