ethyl 1-[(2-bromanyl-5-ethoxycarbonyloxy-4-methoxy-phenyl)methyl]-7-ethoxycarbonyloxy-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: ethyl 1-[(2-bromanyl-5-ethoxycarbonyloxy-4-methoxy-phenyl)methyl]-7-ethoxycarbonyloxy-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: ethyl 1-[(2-bromo-5-ethoxycarbonyloxy-4-methoxy-phenyl)methyl]-7-ethoxycarbonyloxy-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 1-[(2-bromo-5-ethoxycarbonyloxy-4-methoxyphenyl)methyl]-7-ethoxycarbonyloxy-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2-bromo-5-ethoxycarbonyloxy-4-methoxyphenyl)methyl]-7-ethoxycarbonyloxy-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 1-(2-bromo-5-carbethoxyoxy-4-methoxy-benzyl)-7-carbethoxyoxy-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid ethyl ester Formula: C27H32BrNO10 MolecularWeight: 610.44768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3Br)OC)OC(=O)OCC)OC(=O)OCC)OC

Isomeric SMILES

CCOC(=O)N1CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3Br)OC)OC(=O)OCC)OC(=O)OCC)OC

InChI

InChI=1S/C27H32BrNO10/c1-6-35-25(30)29-10-9-16-12-21(33-4)24(39-27(32)37-8-3)14-18(16)20(29)11-17-13-23(38-26(31)36-7-2)22(34-5)15-19(17)28/h12-15,20H,6-11H2,1-5H3