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

Systemtic Name: 8-butyl-2,9,10-trimethoxy-3-octoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium Openeye Name: 8-butyl-2,9,10-trimethoxy-3-octoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium CAS Name: 8-butyl-2,9,10-trimethoxy-3-octoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium IUPAC Name: 8-butyl-2,9,10-trimethoxy-3-octoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium Traditional Name: 8-butyl-2,9,10-trimethoxy-3-octoxy-5,6-dihydroisoquinolin[2,1-b]isoquinolin-7-ium Formula: C32H44NO4+ MolecularWeight: 506.69606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C2C(=C1)CC[N+]3=C2C=C4C=CC(=C(C4=C3CCCC)OC)OC)OC

Isomeric SMILES

CCCCCCCCOC1=C(C=C2C(=C1)CC[N+]3=C2C=C4C=CC(=C(C4=C3CCCC)OC)OC)OC

InChI

InChI=1S/C32H44NO4/c1-6-8-10-11-12-13-19-37-30-21-23-17-18-33-26(14-9-7-2)31-24(15-16-28(34-3)32(31)36-5)20-27(33)25(23)22-29(30)35-4/h15-16,20-22H,6-14,17-19H2,1-5H3/q+1