13-ethyl-2,3,10-trimethoxy-9-[(4-phenylmethoxyphenyl)methoxy]-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium

Systemtic Name: 13-ethyl-2,3,10-trimethoxy-9-[(4-phenylmethoxyphenyl)methoxy]-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium Openeye Name: 9-[(4-benzyloxyphenyl)methoxy]-13-ethyl-2,3,10-trimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium CAS Name: 13-ethyl-2,3,10-trimethoxy-9-[(4-phenylmethoxyphenyl)methoxy]-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium IUPAC Name: 13-ethyl-2,3,10-trimethoxy-9-[(4-phenylmethoxyphenyl)methoxy]-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium Traditional Name: 9-(4-benzoxybenzyl)oxy-13-ethyl-2,3,10-trimethoxy-5,6-dihydroisoquinolin[2,1-b]isoquinolin-7-ium Formula: C36H36NO5+ MolecularWeight: 562.67474

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C=CC(=C(C2=C[N+]3=C1C4=CC(=C(C=C4CC3)OC)OC)OCC5=CC=C(C=C5)OCC6=CC=CC=C6)OC

Isomeric SMILES

CCC1=C2C=CC(=C(C2=C[N+]3=C1C4=CC(=C(C=C4CC3)OC)OC)OCC5=CC=C(C=C5)OCC6=CC=CC=C6)OC

InChI

InChI=1S/C36H36NO5/c1-5-28-29-15-16-32(38-2)36(42-23-25-11-13-27(14-12-25)41-22-24-9-7-6-8-10-24)31(29)21-37-18-17-26-19-33(39-3)34(40-4)20-30(26)35(28)37/h6-16,19-21H,5,17-18,22-23H2,1-4H3/q+1