dipropan-2-yl 2-[7-bromanyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-1H-isoquinolin-1-yl]propanedioate

Systemtic Name: dipropan-2-yl 2-[7-bromanyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-1H-isoquinolin-1-yl]propanedioate Openeye Name: diisopropyl 2-(7-bromo-2-tert-butoxycarbonyl-3,4-dihydro-1H-isoquinolin-1-yl)propanedioate CAS Name: 2-[7-bromo-2-[(2-methylpropan-2-yl)oxy-oxomethyl]-3,4-dihydro-1H-isoquinolin-1-yl]propanedioic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl 2-[7-bromo-2-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-1H-isoquinolin-1-yl]propanedioate Traditional Name: 2-(7-bromo-2-tert-butoxycarbonyl-3,4-dihydro-1H-isoquinolin-1-yl)malonic acid diisopropyl ester Formula: C23H32BrNO6 MolecularWeight: 498.40728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(C1C2=C(CCN1C(=O)OC(C)(C)C)C=CC(=C2)Br)C(=O)OC(C)C

Isomeric SMILES

CC(C)OC(=O)C(C1C2=C(CCN1C(=O)OC(C)(C)C)C=CC(=C2)Br)C(=O)OC(C)C

InChI

InChI=1S/C23H32BrNO6/c1-13(2)29-20(26)18(21(27)30-14(3)4)19-17-12-16(24)9-8-15(17)10-11-25(19)22(28)31-23(5,6)7/h8-9,12-14,18-19H,10-11H2,1-7H3