1-[[4-[2-methoxy-5-[(2-methylisoquinolin-2-ium-1-yl)methyl]phenoxy]phenyl]methyl]-2-methyl-isoquinolin-2-ium

Systemtic Name: 1-[[4-[2-methoxy-5-[(2-methylisoquinolin-2-ium-1-yl)methyl]phenoxy]phenyl]methyl]-2-methyl-isoquinolin-2-ium Openeye Name: 1-[[4-[2-methoxy-5-[(2-methylisoquinolin-2-ium-1-yl)methyl]phenoxy]phenyl]methyl]-2-methyl-isoquinolin-2-ium CAS Name: 1-[[4-[2-methoxy-5-[(2-methyl-1-isoquinolin-2-iumyl)methyl]phenoxy]phenyl]methyl]-2-methylisoquinolin-2-ium IUPAC Name: 1-[[4-[2-methoxy-5-[(2-methylisoquinolin-2-ium-1-yl)methyl]phenoxy]phenyl]methyl]-2-methylisoquinolin-2-ium Traditional Name: 1-[4-[2-methoxy-5-[(2-methylisoquinolin-2-ium-1-yl)methyl]phenoxy]benzyl]-2-methyl-isoquinolin-2-ium Formula: C35H32N2O2+2 MolecularWeight: 512.64078

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C2=CC=CC=C2C=C1)CC3=CC=C(C=C3)OC4=C(C=CC(=C4)CC5=[N+](C=CC6=CC=CC=C65)C)OC

Isomeric SMILES

C[N+]1=C(C2=CC=CC=C2C=C1)CC3=CC=C(C=C3)OC4=C(C=CC(=C4)CC5=[N+](C=CC6=CC=CC=C65)C)OC

InChI

InChI=1S/C35H32N2O2/c1-36-20-18-27-8-4-6-10-30(27)32(36)22-25-12-15-29(16-13-25)39-35-24-26(14-17-34(35)38-3)23-33-31-11-7-5-9-28(31)19-21-37(33)2/h4-21,24H,22-23H2,1-3H3/q+2