diethyl 2-[[(2S,3R)-3-(bromomethyl)oxiran-2-yl]methyl]-2-phenethyl-propanedioate

Systemtic Name: diethyl 2-[[(2S,3R)-3-(bromomethyl)oxiran-2-yl]methyl]-2-phenethyl-propanedioate Openeye Name: diethyl 2-[[(2S,3R)-3-(bromomethyl)oxiran-2-yl]methyl]-2-phenethyl-propanedioate CAS Name: 2-[[(2S,3R)-3-(bromomethyl)-2-oxiranyl]methyl]-2-phenethylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(2S,3R)-3-(bromomethyl)oxiran-2-yl]methyl]-2-phenethylpropanedioate Traditional Name: 2-[[(2S,3R)-3-(bromomethyl)oxiran-2-yl]methyl]-2-phenethyl-malonic acid diethyl ester Formula: C19H25BrO5 MolecularWeight: 413.3028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)(CC2C(O2)CBr)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)(C[C@H]2[C@@H](O2)CBr)C(=O)OCC

InChI

InChI=1S/C19H25BrO5/c1-3-23-17(21)19(18(22)24-4-2,12-15-16(13-20)25-15)11-10-14-8-6-5-7-9-14/h5-9,15-16H,3-4,10-13H2,1-2H3/t15-,16-/m0/s1