[2-(4-bromophenyl)-2-oxidanylidene-ethyl] (2S)-2-methylbutanoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] (2S)-2-methylbutanoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] (2S)-2-methylbutanoate CAS Name: (2S)-2-methylbutanoic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] (2S)-2-methylbutanoate Traditional Name: (2S)-2-methylbutyric acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C13H15BrO3 MolecularWeight: 299.1604

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OCC(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CC[C@H](C)C(=O)OCC(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C13H15BrO3/c1-3-9(2)13(16)17-8-12(15)10-4-6-11(14)7-5-10/h4-7,9H,3,8H2,1-2H3/t9-/m0/s1