ethyl 1-[(2-bromanyl-3,4-dimethoxy-phenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: ethyl 1-[(2-bromanyl-3,4-dimethoxy-phenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: ethyl 1-[(2-bromo-3,4-dimethoxy-phenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 1-[(2-bromo-3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2-bromo-3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 1-(2-bromo-3,4-dimethoxy-benzyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid ethyl ester Formula: C23H28BrNO6 MolecularWeight: 494.37552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC2=CC(=C(C=C2C1CC3=C(C(=C(C=C3)OC)OC)Br)OC)OC

Isomeric SMILES

CCOC(=O)N1CCC2=CC(=C(C=C2C1CC3=C(C(=C(C=C3)OC)OC)Br)OC)OC

InChI

InChI=1S/C23H28BrNO6/c1-6-31-23(26)25-10-9-14-12-19(28-3)20(29-4)13-16(14)17(25)11-15-7-8-18(27-2)22(30-5)21(15)24/h7-8,12-13,17H,6,9-11H2,1-5H3