1-(5-bromanyl-2,4-dimethoxy-phenyl)-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-(5-bromanyl-2,4-dimethoxy-phenyl)-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 6-benzyloxy-1-(5-bromo-2,4-dimethoxy-phenyl)-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(5-bromo-2,4-dimethoxyphenyl)-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(5-bromo-2,4-dimethoxyphenyl)-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 6-benzoxy-1-(5-bromo-2,4-dimethoxy-phenyl)-1,2,3,4-tetrahydroisoquinoline Formula: C24H24BrNO3 MolecularWeight: 454.35626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2C3=C(CCN2)C=C(C=C3)OCC4=CC=CC=C4)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1C2C3=C(CCN2)C=C(C=C3)OCC4=CC=CC=C4)Br)OC

InChI

InChI=1S/C24H24BrNO3/c1-27-22-14-23(28-2)21(25)13-20(22)24-19-9-8-18(12-17(19)10-11-26-24)29-15-16-6-4-3-5-7-16/h3-9,12-14,24,26H,10-11,15H2,1-2H3