1-[[3-methoxy-4-(4-methylphenoxy)phenyl]methyl]-2,2-dimethyl-5-(4-methylphenoxy)-3,4-dihydro-1H-isoquinolin-2-ium

Systemtic Name: 1-[[3-methoxy-4-(4-methylphenoxy)phenyl]methyl]-2,2-dimethyl-5-(4-methylphenoxy)-3,4-dihydro-1H-isoquinolin-2-ium Openeye Name: 1-[[3-methoxy-4-(4-methylphenoxy)phenyl]methyl]-2,2-dimethyl-5-(4-methylphenoxy)-3,4-dihydro-1H-isoquinolin-2-ium CAS Name: 1-[[3-methoxy-4-(4-methylphenoxy)phenyl]methyl]-2,2-dimethyl-5-(4-methylphenoxy)-3,4-dihydro-1H-isoquinolin-2-ium IUPAC Name: 1-[[3-methoxy-4-(4-methylphenoxy)phenyl]methyl]-2,2-dimethyl-5-(4-methylphenoxy)-3,4-dihydro-1H-isoquinolin-2-ium Traditional Name: 1-[3-methoxy-4-(4-methylphenoxy)benzyl]-2,2-dimethyl-5-(4-methylphenoxy)-3,4-dihydro-1H-isoquinolin-2-ium Formula: C33H36NO3+ MolecularWeight: 494.64384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=C(C=C(C=C2)CC3C4=C(CC[N+]3(C)C)C(=CC=C4)OC5=CC=C(C=C5)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)OC2=C(C=C(C=C2)CC3C4=C(CC[N+]3(C)C)C(=CC=C4)OC5=CC=C(C=C5)C)OC

InChI

InChI=1S/C33H36NO3/c1-23-9-14-26(15-10-23)36-31-8-6-7-28-29(31)19-20-34(3,4)30(28)21-25-13-18-32(33(22-25)35-5)37-27-16-11-24(2)12-17-27/h6-18,22,30H,19-21H2,1-5H3/q+1