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The molecular formula is C13H17NO4.
The synonyms are 318465-71-3 and 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)acetic acid.
The molecular weight is 251.28 g/mol.
It was created on August 9, 2005, and last modified on November 25, 2023.
The IUPAC name is 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)acetic acid.
The InChI is InChI=1S/C13H17NO4/c1-17-11-5-9-3-4-14(8-13(15)16)7-10(9)6-12(11)18-2/h5-6H,3-4,7-8H2,1-2H3,(H,15,16).
The InChIKey is KOKCWVXXMLKNQC-UHFFFAOYSA-N.
The canonical SMILES notation is COC1=C(C=C2CN(CCC2=C1)CC(=O)O)OC.
The XLogP3-AA value is -1.
It has 1 hydrogen bond donor count and 5 hydrogen bond acceptor count.
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