(2S)-4-bromanyl-2-(phenylmethoxycarbonylamino)butanoic acid

Systemtic Name: (2S)-4-bromanyl-2-(phenylmethoxycarbonylamino)butanoic acid Openeye Name: (2S)-2-(benzyloxycarbonylamino)-4-bromo-butanoic acid CAS Name: (2S)-4-bromo-2-(phenylmethoxycarbonylamino)butanoic acid IUPAC Name: (2S)-4-bromo-2-(phenylmethoxycarbonylamino)butanoic acid Traditional Name: (2S)-2-(benzyloxycarbonylamino)-4-bromo-butyric acid Formula: C12H14BrNO4 MolecularWeight: 316.14786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCBr)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N[C@@H](CCBr)C(=O)O

InChI

InChI=1S/C12H14BrNO4/c13-7-6-10(11(15)16)14-12(17)18-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H,14,17)(H,15,16)/t10-/m0/s1