3-(2,3,10,11-tetramethoxyisoquinolino[2,1-b]isoquinolin-7-ium-8-yl)propanoic acid

Systemtic Name: 3-(2,3,10,11-tetramethoxyisoquinolino[2,1-b]isoquinolin-7-ium-8-yl)propanoic acid Openeye Name: 3-(2,3,10,11-tetramethoxyisoquinolino[2,1-b]isoquinolin-7-ium-8-yl)propanoic acid CAS Name: 3-(2,3,10,11-tetramethoxy-8-isoquinolino[2,1-b]isoquinolin-7-iumyl)propanoic acid IUPAC Name: 3-(2,3,10,11-tetramethoxyisoquinolino[2,1-b]isoquinolin-7-ium-8-yl)propanoic acid Traditional Name: 3-(2,3,10,11-tetramethoxyisoquinolin[2,1-b]isoquinolin-7-ium-8-yl)propionic acid Formula: C24H24NO6+ MolecularWeight: 422.45046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC3=[N+](C=CC4=CC(=C(C=C43)OC)OC)C(=C2C=C1OC)CCC(=O)O

Isomeric SMILES

COC1=CC2=CC3=[N+](C=CC4=CC(=C(C=C43)OC)OC)C(=C2C=C1OC)CCC(=O)O

InChI

InChI=1S/C24H23NO6/c1-28-20-10-14-7-8-25-18(5-6-24(26)27)17-13-23(31-4)21(29-2)11-15(17)9-19(25)16(14)12-22(20)30-3/h7-13H,5-6H2,1-4H3/p+1