3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-1-ol

Systemtic Name: 3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-1-ol Openeye Name: 3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-1-ol CAS Name: 3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-1-propanol IUPAC Name: 3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-1-ol Traditional Name: 3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-1-ol Formula: C14H22NO3+ MolecularWeight: 252.32938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C[NH+](CCC2=C1)CCCO)OC

Isomeric SMILES

COC1=C(C=C2C[NH+](CCC2=C1)CCCO)OC

InChI

InChI=1S/C14H21NO3/c1-17-13-8-11-4-6-15(5-3-7-16)10-12(11)9-14(13)18-2/h8-9,16H,3-7,10H2,1-2H3/p+1