1-(5-bromanyl-2,4-dimethoxy-phenyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-(5-bromanyl-2,4-dimethoxy-phenyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 1-(5-bromo-2,4-dimethoxy-phenyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(5-bromo-2,4-dimethoxyphenyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(5-bromo-2,4-dimethoxyphenyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 1-(5-bromo-2,4-dimethoxy-phenyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline Formula: C21H26BrNO4 MolecularWeight: 436.33944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(NCCC2=C1)C3=CC(=C(C=C3OC)OC)Br)OCC

Isomeric SMILES

CCOC1=C(C=C2C(NCCC2=C1)C3=CC(=C(C=C3OC)OC)Br)OCC

InChI

InChI=1S/C21H26BrNO4/c1-5-26-19-9-13-7-8-23-21(14(13)11-20(19)27-6-2)15-10-16(22)18(25-4)12-17(15)24-3/h9-12,21,23H,5-8H2,1-4H3