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

Systemtic Name: 1-(2-bromanyl-3,4,5-trimethoxy-phenyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 1-(2-bromo-3,4,5-trimethoxy-phenyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(2-bromo-3,4,5-trimethoxyphenyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(2-bromo-3,4,5-trimethoxyphenyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 1-(2-bromo-3,4,5-trimethoxy-phenyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline Formula: C22H28BrNO5 MolecularWeight: 466.36542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(NCCC2=C1)C3=CC(=C(C(=C3Br)OC)OC)OC)OCC

Isomeric SMILES

CCOC1=C(C=C2C(NCCC2=C1)C3=CC(=C(C(=C3Br)OC)OC)OC)OCC

InChI

InChI=1S/C22H28BrNO5/c1-6-28-16-10-13-8-9-24-20(14(13)11-17(16)29-7-2)15-12-18(25-3)21(26-4)22(27-5)19(15)23/h10-12,20,24H,6-9H2,1-5H3