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

Systemtic Name: 1-(5-bromanyl-2-methoxy-phenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 7-benzyloxy-1-(5-bromo-2-methoxy-phenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(5-bromo-2-methoxyphenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(5-bromo-2-methoxyphenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 7-benzoxy-1-(5-bromo-2-methoxy-phenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline Formula: C24H24BrNO3 MolecularWeight: 454.35626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C2C3=CC(=C(C=C3CCN2)OC)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C2C3=CC(=C(C=C3CCN2)OC)OCC4=CC=CC=C4

InChI

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