2,3,10,11-tetramethoxy-8-phenyl-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-7-ium

Systemtic Name: 2,3,10,11-tetramethoxy-8-phenyl-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-7-ium Openeye Name: 2,3,10,11-tetramethoxy-8-phenyl-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-7-ium CAS Name: 2,3,10,11-tetramethoxy-8-phenyl-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-7-ium IUPAC Name: 2,3,10,11-tetramethoxy-8-phenyl-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-7-ium Traditional Name: 2,3,10,11-tetramethoxy-8-phenyl-5,6,13,13a-tetrahydroisoquinolin[2,1-b]isoquinolin-7-ium Formula: C27H28NO4+ MolecularWeight: 430.51552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C3CC4=CC(=C(C=C4C(=[N+]3CCC2=C1)C5=CC=CC=C5)OC)OC)OC

Isomeric SMILES

COC1=C(C=C2C3CC4=CC(=C(C=C4C(=[N+]3CCC2=C1)C5=CC=CC=C5)OC)OC)OC

InChI

InChI=1S/C27H28NO4/c1-29-23-13-18-10-11-28-22(20(18)15-25(23)31-3)12-19-14-24(30-2)26(32-4)16-21(19)27(28)17-8-6-5-7-9-17/h5-9,13-16,22H,10-12H2,1-4H3/q+1