2-(3-methoxy-8-oxidanyl-5,6,7,8-tetrahydroisoquinolin-7-yl)ethanoate

Systemtic Name: 2-(3-methoxy-8-oxidanyl-5,6,7,8-tetrahydroisoquinolin-7-yl)ethanoate Openeye Name: 2-(8-hydroxy-3-methoxy-5,6,7,8-tetrahydroisoquinolin-7-yl)acetate CAS Name: 2-(8-hydroxy-3-methoxy-5,6,7,8-tetrahydroisoquinolin-7-yl)acetate IUPAC Name: 2-(8-hydroxy-3-methoxy-5,6,7,8-tetrahydroisoquinolin-7-yl)acetate Traditional Name: 2-(8-hydroxy-3-methoxy-5,6,7,8-tetrahydroisoquinolin-7-yl)acetate Formula: C12H14NO4- MolecularWeight: 236.24386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C2C(C(CCC2=C1)CC(=O)[O-])O

Isomeric SMILES

COC1=NC=C2C(C(CCC2=C1)CC(=O)[O-])O

InChI

InChI=1S/C12H15NO4/c1-17-10-4-7-2-3-8(5-11(14)15)12(16)9(7)6-13-10/h4,6,8,12,16H,2-3,5H2,1H3,(H,14,15)/p-1