3-[6,7-dimethoxy-2-prop-2-enyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propan-1-ol

Systemtic Name: 3-[6,7-dimethoxy-2-prop-2-enyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propan-1-ol Openeye Name: 3-[2-allyl-6,7-dimethoxy-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propan-1-ol CAS Name: 3-[6,7-dimethoxy-2-prop-2-enyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]-1-propanol IUPAC Name: 3-[6,7-dimethoxy-2-prop-2-enyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propan-1-ol Traditional Name: 3-[2-allyl-6,7-dimethoxy-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propan-1-ol Formula: C26H36NO6+ MolecularWeight: 458.56714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2C3=CC(=C(C=C3CC[N+]2(CCCO)CC=C)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2C3=CC(=C(C=C3CC[N+]2(CCCO)CC=C)OC)OC

InChI

InChI=1S/C26H36NO6/c1-7-10-27(11-8-13-28)12-9-18-14-21(29-2)22(30-3)17-20(18)25(27)19-15-23(31-4)26(33-6)24(16-19)32-5/h7,14-17,25,28H,1,8-13H2,2-6H3/q+1