(2R)-3-[2,2-bis(chloranyl)ethenylsulfanyl]-2-(2,2,2-trideuterioethanoylamino)propanoic acid

Systemtic Name: (2R)-3-[2,2-bis(chloranyl)ethenylsulfanyl]-2-(2,2,2-trideuterioethanoylamino)propanoic acid Openeye Name: (2R)-3-(2,2-dichlorovinylsulfanyl)-2-[(2,2,2-trideuterioacetyl)amino]propanoic acid CAS Name: (2R)-3-(2,2-dichloroethenylthio)-2-[(2,2,2-trideuterio-1-oxoethyl)amino]propanoic acid IUPAC Name: (2R)-3-(2,2-dichloroethenylsulfanyl)-2-[(2,2,2-trideuterioacetyl)amino]propanoic acid Traditional Name: (2R)-3-(2,2-dichlorovinylthio)-2-[(2,2,2-trideuterioacetyl)amino]propionic acid Formula: C7H9Cl2NO3S MolecularWeight: 261.140745

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC=C(Cl)Cl)C(=O)O

Isomeric SMILES

[2H]C([2H])([2H])C(=O)N[C@@H](CSC=C(Cl)Cl)C(=O)O

InChI

InChI=1S/C7H9Cl2NO3S/c1-4(11)10-5(7(12)13)2-14-3-6(8)9/h3,5H,2H2,1H3,(H,10,11)(H,12,13)/t5-/m0/s1/i1D3