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

Systemtic Name: 1-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 7-benzyloxy-1-[(2-bromo-4,5-dimethoxy-phenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-[(2-bromo-4,5-dimethoxyphenyl)methyl]-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-[(2-bromo-4,5-dimethoxyphenyl)methyl]-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 7-benzoxy-1-(2-bromo-4,5-dimethoxy-benzyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline Formula: C26H28BrNO4 MolecularWeight: 498.40882

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(NCCC2=C1)CC3=CC(=C(C=C3Br)OC)OC)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C2C(NCCC2=C1)CC3=CC(=C(C=C3Br)OC)OC)OCC4=CC=CC=C4

InChI

InChI=1S/C26H28BrNO4/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/h4-8,12-15,22,28H,9-11,16H2,1-3H3