5-[[(1R)-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]methyl]-1,2-oxazole

Systemtic Name: 5-[[(1R)-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]methyl]-1,2-oxazole Openeye Name: 5-[[(1R)-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]methyl]isoxazole CAS Name: 5-[[(1R)-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]methyl]isoxazole IUPAC Name: 5-[[(1R)-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]methyl]-1,2-oxazole Traditional Name: 5-[[(1R)-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]methyl]isoxazole Formula: C21H23N2O3+ MolecularWeight: 351.41892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C([NH+](CCC2=C1)CC3=CC=NO3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2[C@H]([NH+](CCC2=C1)CC3=CC=NO3)C4=CC=CC=C4)OC

InChI

InChI=1S/C21H22N2O3/c1-24-19-12-16-9-11-23(14-17-8-10-22-26-17)21(15-6-4-3-5-7-15)18(16)13-20(19)25-2/h3-8,10,12-13,21H,9,11,14H2,1-2H3/p+1/t21-/m1/s1