(1R,3R)-8-methoxy-1,3-dimethyl-6-phenylmethoxy-2-(phenylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: (1R,3R)-8-methoxy-1,3-dimethyl-6-phenylmethoxy-2-(phenylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: (1R,3R)-2-benzyl-6-benzyloxy-8-methoxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: (1R,3R)-8-methoxy-1,3-dimethyl-6-phenylmethoxy-2-(phenylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: (1R,3R)-2-benzyl-8-methoxy-1,3-dimethyl-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: (1R,3R)-6-benzoxy-2-benzyl-8-methoxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C26H30NO2+ MolecularWeight: 388.5219

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC(=CC(=C2C([NH+]1CC3=CC=CC=C3)C)OC)OCC4=CC=CC=C4

Isomeric SMILES

C[C@@H]1CC2=CC(=CC(=C2[C@H]([NH+]1CC3=CC=CC=C3)C)OC)OCC4=CC=CC=C4

InChI

InChI=1S/C26H29NO2/c1-19-14-23-15-24(29-18-22-12-8-5-9-13-22)16-25(28-3)26(23)20(2)27(19)17-21-10-6-4-7-11-21/h4-13,15-16,19-20H,14,17-18H2,1-3H3/p+1/t19-,20-/m1/s1