3-(chloromethylsulfanyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

Systemtic Name: 3-(chloromethylsulfanyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-3-(chloromethylsulfanyl)propanoic acid CAS Name: 3-(chloromethylthio)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: 3-(chloromethylsulfanyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-3-(chloromethylthio)propionic acid Formula: C9H16ClNO4S MolecularWeight: 269.74564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CSCCl)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CSCCl)C(=O)O

InChI

InChI=1S/C9H16ClNO4S/c1-9(2,3)15-8(14)11-6(7(12)13)4-16-5-10/h6H,4-5H2,1-3H3,(H,11,14)(H,12,13)