methyl (2S)-6-bromanyl-2-(phenylmethoxycarbonylamino)hexanoate

Systemtic Name: methyl (2S)-6-bromanyl-2-(phenylmethoxycarbonylamino)hexanoate Openeye Name: methyl (2S)-2-(benzyloxycarbonylamino)-6-bromo-hexanoate CAS Name: (2S)-6-bromo-2-(phenylmethoxycarbonylamino)hexanoic acid methyl ester IUPAC Name: methyl (2S)-6-bromo-2-(phenylmethoxycarbonylamino)hexanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-6-bromo-hexanoic acid methyl ester Formula: C15H20BrNO4 MolecularWeight: 358.2276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20BrNO4/c1-20-14(18)13(9-5-6-10-16)17-15(19)21-11-12-7-3-2-4-8-12/h2-4,7-8,13H,5-6,9-11H2,1H3,(H,17,19)/t13-/m0/s1