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

Systemtic Name: 1-[3,4-bis(bromanyl)phenyl]-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 7-benzyloxy-1-(3,4-dibromophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(3,4-dibromophenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(3,4-dibromophenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 7-benzoxy-1-(3,4-dibromophenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline Formula: C23H21Br2NO2 MolecularWeight: 503.22634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(NCCC2=C1)C3=CC(=C(C=C3)Br)Br)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C2C(NCCC2=C1)C3=CC(=C(C=C3)Br)Br)OCC4=CC=CC=C4

InChI

InChI=1S/C23H21Br2NO2/c1-27-21-12-16-9-10-26-23(17-7-8-19(24)20(25)11-17)18(16)13-22(21)28-14-15-5-3-2-4-6-15/h2-8,11-13,23,26H,9-10,14H2,1H3