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

Systemtic Name: 9-[(4-bromophenyl)methoxy]-13-ethyl-2,3,10-trimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium Openeye Name: 9-[(4-bromophenyl)methoxy]-13-ethyl-2,3,10-trimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium CAS Name: 9-[(4-bromophenyl)methoxy]-13-ethyl-2,3,10-trimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium IUPAC Name: 9-[(4-bromophenyl)methoxy]-13-ethyl-2,3,10-trimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium Traditional Name: 9-(4-bromobenzyl)oxy-13-ethyl-2,3,10-trimethoxy-5,6-dihydroisoquinolin[2,1-b]isoquinolin-7-ium Formula: C29H29BrNO4+ MolecularWeight: 535.44886

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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)Br)OC

Isomeric SMILES

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

InChI

InChI=1S/C29H29BrNO4/c1-5-21-22-10-11-25(32-2)29(35-17-18-6-8-20(30)9-7-18)24(22)16-31-13-12-19-14-26(33-3)27(34-4)15-23(19)28(21)31/h6-11,14-16H,5,12-13,17H2,1-4H3/q+1