O2-tert-butyl O1-methyl (1R)-6-[(5-bromanyl-2-methoxy-phenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate

Systemtic Name: O2-tert-butyl O1-methyl (1R)-6-[(5-bromanyl-2-methoxy-phenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate Openeye Name: O2-tert-butyl O1-methyl (1R)-6-[(5-bromo-2-methoxy-phenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate CAS Name: (1R)-6-[(5-bromo-2-methoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylic acid O2-tert-butyl ester O1-methyl ester IUPAC Name: 2-O-tert-butyl 1-O-methyl (1R)-6-[(5-bromo-2-methoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate Traditional Name: (1R)-6-(5-bromo-2-methoxy-benzyl)oxy-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylic acid O2-tert-butyl ester O1-methyl ester Formula: C24H28BrNO6 MolecularWeight: 506.38622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=C(C1C(=O)OC)C=CC(=C2)OCC3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=C([C@@H]1C(=O)OC)C=CC(=C2)OCC3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C24H28BrNO6/c1-24(2,3)32-23(28)26-11-10-15-13-18(7-8-19(15)21(26)22(27)30-5)31-14-16-12-17(25)6-9-20(16)29-4/h6-9,12-13,21H,10-11,14H2,1-5H3/t21-/m1/s1