methyl (4S)-6-bromanyl-5-oxidanylidene-4-(phenylmethoxycarbonylamino)hexanoate

Systemtic Name: methyl (4S)-6-bromanyl-5-oxidanylidene-4-(phenylmethoxycarbonylamino)hexanoate Openeye Name: methyl (4S)-4-(benzyloxycarbonylamino)-6-bromo-5-oxo-hexanoate CAS Name: (4S)-6-bromo-5-oxo-4-(phenylmethoxycarbonylamino)hexanoic acid methyl ester IUPAC Name: methyl (4S)-6-bromo-5-oxo-4-(phenylmethoxycarbonylamino)hexanoate Traditional Name: (4S)-4-(benzyloxycarbonylamino)-6-bromo-5-keto-hexanoic acid methyl ester Formula: C15H18BrNO5 MolecularWeight: 372.21112

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(C(=O)CBr)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C15H18BrNO5/c1-21-14(19)8-7-12(13(18)9-16)17-15(20)22-10-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3,(H,17,20)/t12-/m0/s1