[(1R,2R)-2-bromanyl-3-ethoxy-3-oxidanylidene-1-phenyl-propyl] butanoate

Systemtic Name: [(1R,2R)-2-bromanyl-3-ethoxy-3-oxidanylidene-1-phenyl-propyl] butanoate Openeye Name: [(1R,2R)-2-bromo-3-ethoxy-3-oxo-1-phenyl-propyl] butanoate CAS Name: butanoic acid [(1R,2R)-2-bromo-3-ethoxy-3-oxo-1-phenylpropyl] ester IUPAC Name: [(1R,2R)-2-bromo-3-ethoxy-3-oxo-1-phenylpropyl] butanoate Traditional Name: butyric acid [(1R,2R)-2-bromo-3-ethoxy-3-keto-1-phenyl-propyl] ester Formula: C15H19BrO4 MolecularWeight: 343.21296

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC(C1=CC=CC=C1)C(C(=O)OCC)Br

Isomeric SMILES

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

InChI

InChI=1S/C15H19BrO4/c1-3-8-12(17)20-14(11-9-6-5-7-10-11)13(16)15(18)19-4-2/h5-7,9-10,13-14H,3-4,8H2,1-2H3/t13-,14-/m1/s1