(2R)-1-(2-methylpent-4-yn-2-yloxy)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-2-ol

Systemtic Name: (2R)-1-(2-methylpent-4-yn-2-yloxy)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-2-ol Openeye Name: (2R)-1-(1,1-dimethylbut-3-ynoxy)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-2-ol CAS Name: (2R)-1-(2-methylpent-4-yn-2-yloxy)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-2-propanol IUPAC Name: (2R)-1-(2-methylpent-4-yn-2-yloxy)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-2-ol Traditional Name: (2R)-1-(1,1-dimethylbut-3-ynoxy)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-2-ol Formula: C18H26NO2+ MolecularWeight: 288.40454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC#C)OCC(C[NH+]1CCC2=CC=CC=C2C1)O

Isomeric SMILES

CC(C)(CC#C)OC[C@@H](C[NH+]1CCC2=CC=CC=C2C1)O

InChI

InChI=1S/C18H25NO2/c1-4-10-18(2,3)21-14-17(20)13-19-11-9-15-7-5-6-8-16(15)12-19/h1,5-8,17,20H,9-14H2,2-3H3/p+1/t17-/m1/s1