ethyl 1-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]-6,7-dimethoxy-1-oxidanyl-3,4-dihydroisoquinoline-2-carboxylate

Systemtic Name: ethyl 1-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]-6,7-dimethoxy-1-oxidanyl-3,4-dihydroisoquinoline-2-carboxylate Openeye Name: ethyl 1-[(2-bromo-4,5-dimethoxy-phenyl)methyl]-1-hydroxy-6,7-dimethoxy-3,4-dihydroisoquinoline-2-carboxylate CAS Name: 1-[(2-bromo-4,5-dimethoxyphenyl)methyl]-1-hydroxy-6,7-dimethoxy-3,4-dihydroisoquinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2-bromo-4,5-dimethoxyphenyl)methyl]-1-hydroxy-6,7-dimethoxy-3,4-dihydroisoquinoline-2-carboxylate Traditional Name: 1-(2-bromo-4,5-dimethoxy-benzyl)-1-hydroxy-6,7-dimethoxy-3,4-dihydroisoquinoline-2-carboxylic acid ethyl ester Formula: C23H28BrNO7 MolecularWeight: 510.37492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC2=CC(=C(C=C2C1(CC3=CC(=C(C=C3Br)OC)OC)O)OC)OC

Isomeric SMILES

CCOC(=O)N1CCC2=CC(=C(C=C2C1(CC3=CC(=C(C=C3Br)OC)OC)O)OC)OC

InChI

InChI=1S/C23H28BrNO7/c1-6-32-22(26)25-8-7-14-9-18(28-2)20(30-4)11-16(14)23(25,27)13-15-10-19(29-3)21(31-5)12-17(15)24/h9-12,27H,6-8,13H2,1-5H3