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

Systemtic Name: ethyl 1-(4-bromophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C20H22BrNO4 MolecularWeight: 420.29698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC2=CC(=C(C=C2C1C3=CC=C(C=C3)Br)OC)OC

Isomeric SMILES

CCOC(=O)N1CCC2=CC(=C(C=C2C1C3=CC=C(C=C3)Br)OC)OC

InChI

InChI=1S/C20H22BrNO4/c1-4-26-20(23)22-10-9-14-11-17(24-2)18(25-3)12-16(14)19(22)13-5-7-15(21)8-6-13/h5-8,11-12,19H,4,9-10H2,1-3H3