methyl 1-(4-bromophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: methyl 1-(4-bromophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: methyl 1-(4-bromophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 1-(4-bromophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid methyl ester IUPAC Name: methyl 1-(4-bromophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 1-(4-bromophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid methyl ester Formula: C19H20BrNO4 MolecularWeight: 406.2704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)OC)C3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)OC)C3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C19H20BrNO4/c1-23-16-10-13-8-9-21(19(22)25-3)18(15(13)11-17(16)24-2)12-4-6-14(20)7-5-12/h4-7,10-11,18H,8-9H2,1-3H3