6,7-dimethoxy-1-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydro-2H-isoquinolin-8-one hydrochloride

Systemtic Name: 6,7-dimethoxy-1-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydro-2H-isoquinolin-8-one hydrochloride Openeye Name: 6,7-dimethoxy-1-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydro-2H-isoquinolin-8-one hydrochloride CAS Name: 6,7-dimethoxy-1-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydro-2H-isoquinolin-8-one hydrochloride IUPAC Name: 6,7-dimethoxy-1-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydro-2H-isoquinolin-8-one hydrochloride Traditional Name: 6,7-dimethoxy-1-(3,4,5-trimethoxybenzyl)-3,4-dihydro-2H-isoquinolin-8-one hydrochloride Formula: C21H26ClNO6 MolecularWeight: 423.88724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC2=C3C(=CC(=C(C3=O)OC)OC)CCN2.Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC2=C3C(=CC(=C(C3=O)OC)OC)CCN2.Cl

InChI

InChI=1S/C21H25NO6.ClH/c1-24-15-9-12(10-16(25-2)20(15)27-4)8-14-18-13(6-7-22-14)11-17(26-3)21(28-5)19(18)23;/h9-11,22H,6-8H2,1-5H3;1H