1-[(4-hydroxyphenyl)methyl]-7-methoxy-6-oxidanyl-3,4-dihydro-2H-isoquinoline-1-carboxylic acid hydrochloride

Systemtic Name: 1-[(4-hydroxyphenyl)methyl]-7-methoxy-6-oxidanyl-3,4-dihydro-2H-isoquinoline-1-carboxylic acid hydrochloride Openeye Name: 6-hydroxy-1-[(4-hydroxyphenyl)methyl]-7-methoxy-3,4-dihydro-2H-isoquinoline-1-carboxylic acid hydrochloride CAS Name: 6-hydroxy-1-[(4-hydroxyphenyl)methyl]-7-methoxy-3,4-dihydro-2H-isoquinoline-1-carboxylic acid hydrochloride IUPAC Name: 6-hydroxy-1-[(4-hydroxyphenyl)methyl]-7-methoxy-3,4-dihydro-2H-isoquinoline-1-carboxylic acid hydrochloride Traditional Name: 6-hydroxy-1-(4-hydroxybenzyl)-7-methoxy-3,4-dihydro-2H-isoquinoline-1-carboxylic acid hydrochloride Formula: C18H20ClNO5 MolecularWeight: 365.8081

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CCNC(C2=C1)(CC3=CC=C(C=C3)O)C(=O)O)O.Cl

Isomeric SMILES

COC1=C(C=C2CCNC(C2=C1)(CC3=CC=C(C=C3)O)C(=O)O)O.Cl

InChI

InChI=1S/C18H19NO5.ClH/c1-24-16-9-14-12(8-15(16)21)6-7-19-18(14,17(22)23)10-11-2-4-13(20)5-3-11;/h2-5,8-9,19-21H,6-7,10H2,1H3,(H,22,23);1H