methyl (2S)-2-bromanyl-5-(4-methoxyphenyl)pentanoate

Systemtic Name: methyl (2S)-2-bromanyl-5-(4-methoxyphenyl)pentanoate Openeye Name: methyl (2S)-2-bromo-5-(4-methoxyphenyl)pentanoate CAS Name: (2S)-2-bromo-5-(4-methoxyphenyl)pentanoic acid methyl ester IUPAC Name: methyl (2S)-2-bromo-5-(4-methoxyphenyl)pentanoate Traditional Name: (2S)-2-bromo-5-(4-methoxyphenyl)valeric acid methyl ester Formula: C13H17BrO3 MolecularWeight: 301.17628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCCC(C(=O)OC)Br

Isomeric SMILES

COC1=CC=C(C=C1)CCC[C@@H](C(=O)OC)Br

InChI

InChI=1S/C13H17BrO3/c1-16-11-8-6-10(7-9-11)4-3-5-12(14)13(15)17-2/h6-9,12H,3-5H2,1-2H3/t12-/m0/s1