ethanoic acid; 2-ethyl-3,4-dihydro-1H-isoquinolin-5-ol; hydrobromide

Systemtic Name: ethanoic acid; 2-ethyl-3,4-dihydro-1H-isoquinolin-5-ol; hydrobromide Openeye Name: acetic acid; 2-ethyl-3,4-dihydro-1H-isoquinolin-5-ol; hydrobromide CAS Name: acetic acid; 2-ethyl-3,4-dihydro-1H-isoquinolin-5-ol; hydrobromide IUPAC Name: acetic acid; 2-ethyl-3,4-dihydro-1H-isoquinolin-5-ol; hydrobromide Traditional Name: acetic acid; 2-ethyl-3,4-dihydro-1H-isoquinolin-5-ol; hydrobromide Formula: C13H20BrNO3 MolecularWeight: 318.2068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2=C(C1)C=CC=C2O.CC(=O)O.Br

Isomeric SMILES

CCN1CCC2=C(C1)C=CC=C2O.CC(=O)O.Br

InChI

InChI=1S/C11H15NO.C2H4O2.BrH/c1-2-12-7-6-10-9(8-12)4-3-5-11(10)13;1-2(3)4;/h3-5,13H,2,6-8H2,1H3;1H3,(H,3,4);1H