[5-acetyloxy-1-[(3,4,5-trimethoxyphenyl)methyl]isoquinolin-7-yl] ethanoate hydrochloride

Systemtic Name: [5-acetyloxy-1-[(3,4,5-trimethoxyphenyl)methyl]isoquinolin-7-yl] ethanoate hydrochloride Openeye Name: [5-acetoxy-1-[(3,4,5-trimethoxyphenyl)methyl]-7-isoquinolyl] acetate hydrochloride CAS Name: acetic acid [5-acetyloxy-1-[(3,4,5-trimethoxyphenyl)methyl]-7-isoquinolinyl] ester hydrochloride IUPAC Name: [5-acetyloxy-1-[(3,4,5-trimethoxyphenyl)methyl]isoquinolin-7-yl] acetate hydrochloride Traditional Name: acetic acid [5-acetoxy-1-(3,4,5-trimethoxybenzyl)-7-isoquinolyl] ester hydrochloride Formula: C23H24ClNO7 MolecularWeight: 461.89216

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC(=C2C=CN=C(C2=C1)CC3=CC(=C(C(=C3)OC)OC)OC)OC(=O)C.Cl

Isomeric SMILES

CC(=O)OC1=CC(=C2C=CN=C(C2=C1)CC3=CC(=C(C(=C3)OC)OC)OC)OC(=O)C.Cl

InChI

InChI=1S/C23H23NO7.ClH/c1-13(25)30-16-11-18-17(20(12-16)31-14(2)26)6-7-24-19(18)8-15-9-21(27-3)23(29-5)22(10-15)28-4;/h6-7,9-12H,8H2,1-5H3;1H