O1-methyl O3-(phenylmethyl) 2-[(2R)-1-(4-bromophenyl)-1-oxidanylidene-propan-2-yl]propanedioate

Systemtic Name: O1-methyl O3-(phenylmethyl) 2-[(2R)-1-(4-bromophenyl)-1-oxidanylidene-propan-2-yl]propanedioate Openeye Name: O1-benzyl O3-methyl 2-[(1R)-2-(4-bromophenyl)-1-methyl-2-oxo-ethyl]propanedioate CAS Name: 2-[(2R)-1-(4-bromophenyl)-1-oxopropan-2-yl]propanedioic acid O1-methyl ester O3-(phenylmethyl) ester IUPAC Name: 3-O-benzyl 1-O-methyl 2-[(2R)-1-(4-bromophenyl)-1-oxopropan-2-yl]propanedioate Traditional Name: 2-[(1R)-2-(4-bromophenyl)-2-keto-1-methyl-ethyl]malonic acid O1-benzyl ester O3-methyl ester Formula: C20H19BrO5 MolecularWeight: 419.26586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)OC)C(=O)OCC1=CC=CC=C1)C(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C[C@H](C(C(=O)OC)C(=O)OCC1=CC=CC=C1)C(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C20H19BrO5/c1-13(18(22)15-8-10-16(21)11-9-15)17(19(23)25-2)20(24)26-12-14-6-4-3-5-7-14/h3-11,13,17H,12H2,1-2H3/t13-,17?/m1/s1