6,7-dimethoxy-2-[(1R)-1-phenylethyl]-1-[(3-phenylmethoxyphenyl)methyl]-3,4-dihydroisoquinolin-2-ium

Systemtic Name: 6,7-dimethoxy-2-[(1R)-1-phenylethyl]-1-[(3-phenylmethoxyphenyl)methyl]-3,4-dihydroisoquinolin-2-ium Openeye Name: 1-[(3-benzyloxyphenyl)methyl]-6,7-dimethoxy-2-[(1R)-1-phenylethyl]-3,4-dihydroisoquinolin-2-ium CAS Name: 6,7-dimethoxy-2-[(1R)-1-phenylethyl]-1-[(3-phenylmethoxyphenyl)methyl]-3,4-dihydroisoquinolin-2-ium IUPAC Name: 6,7-dimethoxy-2-[(1R)-1-phenylethyl]-1-[(3-phenylmethoxyphenyl)methyl]-3,4-dihydroisoquinolin-2-ium Traditional Name: 1-(3-benzoxybenzyl)-6,7-dimethoxy-2-[(1R)-1-phenylethyl]-3,4-dihydroisoquinolin-2-ium Formula: C33H34NO3+ MolecularWeight: 492.62796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[N+]2=C(C3=CC(=C(C=C3CC2)OC)OC)CC4=CC(=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

C[C@H](C1=CC=CC=C1)[N+]2=C(C3=CC(=C(C=C3CC2)OC)OC)CC4=CC(=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C33H34NO3/c1-24(27-14-8-5-9-15-27)34-18-17-28-21-32(35-2)33(36-3)22-30(28)31(34)20-26-13-10-16-29(19-26)37-23-25-11-6-4-7-12-25/h4-16,19,21-22,24H,17-18,20,23H2,1-3H3/q+1/t24-/m1/s1