dipropyl 2-[(3R,6R)-2-(4-bromophenyl)-6-methanoyl-1,2-oxazinan-3-yl]propanedioate

Systemtic Name: dipropyl 2-[(3R,6R)-2-(4-bromophenyl)-6-methanoyl-1,2-oxazinan-3-yl]propanedioate Openeye Name: dipropyl 2-[(3R,6R)-2-(4-bromophenyl)-6-formyl-oxazinan-3-yl]propanedioate CAS Name: 2-[(3R,6R)-2-(4-bromophenyl)-6-formyl-3-oxazinanyl]propanedioic acid dipropyl ester IUPAC Name: dipropyl 2-[(3R,6R)-2-(4-bromophenyl)-6-formyloxazinan-3-yl]propanedioate Traditional Name: 2-[(3R,6R)-2-(4-bromophenyl)-6-formyl-oxazinan-3-yl]malonic acid dipropyl ester Formula: C20H26BrNO6 MolecularWeight: 456.32754

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(C1CCC(ON1C2=CC=C(C=C2)Br)C=O)C(=O)OCCC

Isomeric SMILES

CCCOC(=O)C([C@H]1CC[C@@H](ON1C2=CC=C(C=C2)Br)C=O)C(=O)OCCC

InChI

InChI=1S/C20H26BrNO6/c1-3-11-26-19(24)18(20(25)27-12-4-2)17-10-9-16(13-23)28-22(17)15-7-5-14(21)6-8-15/h5-8,13,16-18H,3-4,9-12H2,1-2H3/t16-,17-/m1/s1