(1S)-1-(4-bromophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: (1S)-1-(4-bromophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: (1S)-1-(4-bromophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: (1S)-1-(4-bromophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: (1S)-1-(4-bromophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: (1S)-1-(4-bromophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline Formula: C17H18BrNO2 MolecularWeight: 348.23432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(NCCC2=C1)C3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=C(C=C2[C@@H](NCCC2=C1)C3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C17H18BrNO2/c1-20-15-9-12-7-8-19-17(14(12)10-16(15)21-2)11-3-5-13(18)6-4-11/h3-6,9-10,17,19H,7-8H2,1-2H3/t17-/m0/s1