(1R)-6-methoxy-1-[(4-phenylmethoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-ol

Systemtic Name: (1R)-6-methoxy-1-[(4-phenylmethoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-ol Openeye Name: (1R)-1-[(4-benzyloxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-7-ol CAS Name: (1R)-6-methoxy-1-[(4-phenylmethoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-ol IUPAC Name: (1R)-6-methoxy-1-[(4-phenylmethoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-ol Traditional Name: (1R)-1-(4-benzoxybenzyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-7-ol Formula: C24H26NO3+ MolecularWeight: 376.46814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C([NH2+]CCC2=C1)CC3=CC=C(C=C3)OCC4=CC=CC=C4)O

Isomeric SMILES

COC1=C(C=C2[C@H]([NH2+]CCC2=C1)CC3=CC=C(C=C3)OCC4=CC=CC=C4)O

InChI

InChI=1S/C24H25NO3/c1-27-24-14-19-11-12-25-22(21(19)15-23(24)26)13-17-7-9-20(10-8-17)28-16-18-5-3-2-4-6-18/h2-10,14-15,22,25-26H,11-13,16H2,1H3/p+1/t22-/m1/s1