(3-bromanyl-4-methoxy-phenyl) (2S)-2-bromanylhexanoate

Systemtic Name: (3-bromanyl-4-methoxy-phenyl) (2S)-2-bromanylhexanoate Openeye Name: (3-bromo-4-methoxy-phenyl) (2S)-2-bromohexanoate CAS Name: (2S)-2-bromohexanoic acid (3-bromo-4-methoxyphenyl) ester IUPAC Name: (3-bromo-4-methoxyphenyl) (2S)-2-bromohexanoate Traditional Name: (2S)-2-bromohexanoic acid (3-bromo-4-methoxy-phenyl) ester Formula: C13H16Br2O3 MolecularWeight: 380.07234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC1=CC(=C(C=C1)OC)Br)Br

Isomeric SMILES

CCCC[C@@H](C(=O)OC1=CC(=C(C=C1)OC)Br)Br

InChI

InChI=1S/C13H16Br2O3/c1-3-4-5-10(14)13(16)18-9-6-7-12(17-2)11(15)8-9/h6-8,10H,3-5H2,1-2H3/t10-/m0/s1