5,5-bis[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-7,8-dihydro-6H-isoquinolin-2-ium

Systemtic Name: 5,5-bis[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-7,8-dihydro-6H-isoquinolin-2-ium Openeye Name: 5,5-bis[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-7,8-dihydro-6H-isoquinolin-2-ium CAS Name: 5,5-bis[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-7,8-dihydro-6H-isoquinolin-2-ium IUPAC Name: 5,5-bis[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-7,8-dihydro-6H-isoquinolin-2-ium Traditional Name: 5,5-dihomoveratryl-2-methyl-7,8-dihydro-6H-isoquinolin-2-ium Formula: C30H38NO4+ MolecularWeight: 476.62702

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC2=C(C=C1)C(CCC2)(CCC3=CC(=C(C=C3)OC)OC)CCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

C[N+]1=CC2=C(C=C1)C(CCC2)(CCC3=CC(=C(C=C3)OC)OC)CCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C30H38NO4/c1-31-18-14-25-24(21-31)7-6-15-30(25,16-12-22-8-10-26(32-2)28(19-22)34-4)17-13-23-9-11-27(33-3)29(20-23)35-5/h8-11,14,18-21H,6-7,12-13,15-17H2,1-5H3/q+1