8-ethyl-2,9,10-trimethoxy-3-octoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium chloride

Systemtic Name: 8-ethyl-2,9,10-trimethoxy-3-octoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium chloride Openeye Name: 8-ethyl-2,9,10-trimethoxy-3-octoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium chloride CAS Name: 8-ethyl-2,9,10-trimethoxy-3-octoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium chloride IUPAC Name: 8-ethyl-2,9,10-trimethoxy-3-octoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium chloride Traditional Name: 8-ethyl-2,9,10-trimethoxy-3-octoxy-5,6-dihydroisoquinolin[2,1-b]isoquinolin-7-ium chloride Formula: C30H40ClNO4 MolecularWeight: 514.0959

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C2C(=C1)CC[N+]3=C2C=C4C=CC(=C(C4=C3CC)OC)OC)OC.[Cl-]

Isomeric SMILES

CCCCCCCCOC1=C(C=C2C(=C1)CC[N+]3=C2C=C4C=CC(=C(C4=C3CC)OC)OC)OC.[Cl-]

InChI

InChI=1S/C30H40NO4.ClH/c1-6-8-9-10-11-12-17-35-28-19-21-15-16-31-24(7-2)29-22(13-14-26(32-3)30(29)34-5)18-25(31)23(21)20-27(28)33-4;/h13-14,18-20H,6-12,15-17H2,1-5H3;1H/q+1;/p-1