methyl (2S)-5-bromanyl-2-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: methyl (2S)-5-bromanyl-2-(phenylmethoxycarbonylamino)pentanoate Openeye Name: methyl (2S)-2-(benzyloxycarbonylamino)-5-bromo-pentanoate CAS Name: (2S)-5-bromo-2-(phenylmethoxycarbonylamino)pentanoic acid methyl ester IUPAC Name: methyl (2S)-5-bromo-2-(phenylmethoxycarbonylamino)pentanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-5-bromo-valeric acid methyl ester Formula: C14H18BrNO4 MolecularWeight: 344.20102

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCBr)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

COC(=O)[C@H](CCCBr)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C14H18BrNO4/c1-19-13(17)12(8-5-9-15)16-14(18)20-10-11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-10H2,1H3,(H,16,18)/t12-/m0/s1