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

Systemtic Name: (2R)-1-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-3-phenylmethoxy-propan-2-ol Openeye Name: (2R)-1-benzyloxy-3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-2-ol CAS Name: (2R)-1-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-3-phenylmethoxy-2-propanol IUPAC Name: (2R)-1-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-3-phenylmethoxypropan-2-ol Traditional Name: (2R)-1-benzoxy-3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-2-ol Formula: C21H28NO4+ MolecularWeight: 358.45132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C[NH+](CCC2=C1)CC(COCC3=CC=CC=C3)O)OC

Isomeric SMILES

COC1=C(C=C2C[NH+](CCC2=C1)C[C@H](COCC3=CC=CC=C3)O)OC

InChI

InChI=1S/C21H27NO4/c1-24-20-10-17-8-9-22(12-18(17)11-21(20)25-2)13-19(23)15-26-14-16-6-4-3-5-7-16/h3-7,10-11,19,23H,8-9,12-15H2,1-2H3/p+1/t19-/m1/s1