2-[[(2S)-4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]oxyethanoic acid

Systemtic Name: 2-[[(2S)-4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]oxyethanoic acid Openeye Name: 2-[[(2S)-2-(benzyloxycarbonylamino)-4-methylsulfanyl-butanoyl]amino]oxyacetic acid CAS Name: 2-[[(2S)-4-(methylthio)-1-oxo-2-(phenylmethoxycarbonylamino)butyl]amino]oxyacetic acid IUPAC Name: 2-[[(2S)-4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]oxyacetic acid Traditional Name: 2-[[(2S)-2-(benzyloxycarbonylamino)-4-(methylthio)butanoyl]amino]oxyacetic acid Formula: C15H20N2O6S MolecularWeight: 356.3941

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NOCC(=O)O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CSCC[C@@H](C(=O)NOCC(=O)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C15H20N2O6S/c1-24-8-7-12(14(20)17-23-10-13(18)19)16-15(21)22-9-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3,(H,16,21)(H,17,20)(H,18,19)/t12-/m0/s1