1-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]-6-methoxy-7-phenylmethoxy-3,4-dihydroisoquinoline chloride

Systemtic Name: 1-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]-6-methoxy-7-phenylmethoxy-3,4-dihydroisoquinoline chloride Openeye Name: 7-benzyloxy-1-[(2-bromo-4,5-dimethoxy-phenyl)methyl]-6-methoxy-3,4-dihydroisoquinoline chloride CAS Name: 1-[(2-bromo-4,5-dimethoxyphenyl)methyl]-6-methoxy-7-phenylmethoxy-3,4-dihydroisoquinoline chloride IUPAC Name: 1-[(2-bromo-4,5-dimethoxyphenyl)methyl]-6-methoxy-7-phenylmethoxy-3,4-dihydroisoquinoline chloride Traditional Name: 7-benzoxy-1-(2-bromo-4,5-dimethoxy-benzyl)-6-methoxy-3,4-dihydroisoquinoline chloride Formula: C26H26BrClNO4- MolecularWeight: 531.84594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN=C2CC3=CC(=C(C=C3Br)OC)OC)OCC4=CC=CC=C4.[Cl-]

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN=C2CC3=CC(=C(C=C3Br)OC)OC)OCC4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C26H26BrNO4.ClH/c1-29-23-13-19(21(27)15-25(23)31-3)11-22-20-14-26(32-16-17-7-5-4-6-8-17)24(30-2)12-18(20)9-10-28-22;/h4-8,12-15H,9-11,16H2,1-3H3;1H/p-1