2-(2-ethyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)propane-1,3-diol hydrochloride

Systemtic Name: 2-(2-ethyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)propane-1,3-diol hydrochloride Openeye Name: 2-(2-ethyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)propane-1,3-diol hydrochloride CAS Name: 2-(2-ethyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)propane-1,3-diol hydrochloride IUPAC Name: 2-(2-ethyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)propane-1,3-diol hydrochloride Traditional Name: 2-(2-ethyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl)propane-1,3-diol hydrochloride Formula: C16H26ClNO4 MolecularWeight: 331.83494

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2=CC(=C(C=C2C1C(CO)CO)OC)OC.Cl

Isomeric SMILES

CCN1CCC2=CC(=C(C=C2C1C(CO)CO)OC)OC.Cl

InChI

InChI=1S/C16H25NO4.ClH/c1-4-17-6-5-11-7-14(20-2)15(21-3)8-13(11)16(17)12(9-18)10-19;/h7-8,12,16,18-19H,4-6,9-10H2,1-3H3;1H