methyl (2S)-2-[(4-bromophenyl)methoxy]pentanoate

Systemtic Name: methyl (2S)-2-[(4-bromophenyl)methoxy]pentanoate Openeye Name: methyl (2S)-2-[(4-bromophenyl)methoxy]pentanoate CAS Name: (2S)-2-[(4-bromophenyl)methoxy]pentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(4-bromophenyl)methoxy]pentanoate Traditional Name: (2S)-2-(4-bromobenzyl)oxyvaleric acid methyl ester Formula: C13H17BrO3 MolecularWeight: 301.17628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17BrO3/c1-3-4-12(13(15)16-2)17-9-10-5-7-11(14)8-6-10/h5-8,12H,3-4,9H2,1-2H3/t12-/m0/s1