5-[[4-[2-methoxy-5-[(6-methyl-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)methyl]phenoxy]phenyl]methyl]-6-methyl-[1,3]dioxolo[4,5-g]isoquinolin-6-ium

Systemtic Name: 5-[[4-[2-methoxy-5-[(6-methyl-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)methyl]phenoxy]phenyl]methyl]-6-methyl-[1,3]dioxolo[4,5-g]isoquinolin-6-ium Openeye Name: 5-[[4-[2-methoxy-5-[(6-methyl-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)methyl]phenoxy]phenyl]methyl]-6-methyl-[1,3]dioxolo[4,5-g]isoquinolin-6-ium CAS Name: 5-[[4-[2-methoxy-5-[(6-methyl-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)methyl]phenoxy]phenyl]methyl]-6-methyl-[1,3]dioxolo[4,5-g]isoquinolin-6-ium IUPAC Name: 5-[[4-[2-methoxy-5-[(6-methyl-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)methyl]phenoxy]phenyl]methyl]-6-methyl-[1,3]dioxolo[4,5-g]isoquinolin-6-ium Traditional Name: 5-[4-[2-methoxy-5-[(6-methyl-[1,3]dioxol[4,5-g]isoquinolin-6-ium-5-yl)methyl]phenoxy]benzyl]-6-methyl-[1,3]dioxol[4,5-g]isoquinolin-6-ium Formula: C37H32N2O6+2 MolecularWeight: 600.65978

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C2=CC3=C(C=C2C=C1)OCO3)CC4=CC=C(C=C4)OC5=C(C=CC(=C5)CC6=[N+](C=CC7=CC8=C(C=C76)OCO8)C)OC

Isomeric SMILES

C[N+]1=C(C2=CC3=C(C=C2C=C1)OCO3)CC4=CC=C(C=C4)OC5=C(C=CC(=C5)CC6=[N+](C=CC7=CC8=C(C=C76)OCO8)C)OC

InChI

InChI=1S/C37H32N2O6/c1-38-12-10-25-17-33-35(43-21-41-33)19-28(25)30(38)14-23-4-7-27(8-5-23)45-37-16-24(6-9-32(37)40-3)15-31-29-20-36-34(42-22-44-36)18-26(29)11-13-39(31)2/h4-13,16-20H,14-15,21-22H2,1-3H3/q+2