sodium 2-[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]sulfanyl-2-phenyl-ethanoate

Systemtic Name: sodium 2-[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]sulfanyl-2-phenyl-ethanoate Openeye Name: sodium 2-[(2R)-2-(tert-butoxycarbonylamino)propanoyl]sulfanyl-2-phenyl-acetate CAS Name: sodium 2-[[(2R)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]thio]-2-phenylacetate IUPAC Name: sodium 2-[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]sulfanyl-2-phenylacetate Traditional Name: sodium 2-[[(2R)-2-(tert-butoxycarbonylamino)propanoyl]thio]-2-phenyl-acetate Formula: C16H20NNaO5S MolecularWeight: 361.38847

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)SC(C1=CC=CC=C1)C(=O)[O-])NC(=O)OC(C)(C)C.[Na+]

Isomeric SMILES

C[C@H](C(=O)SC(C1=CC=CC=C1)C(=O)[O-])NC(=O)OC(C)(C)C.[Na+]

InChI

InChI=1S/C16H21NO5S.Na/c1-10(17-15(21)22-16(2,3)4)14(20)23-12(13(18)19)11-8-6-5-7-9-11;/h5-10,12H,1-4H3,(H,17,21)(H,18,19);/q;+1/p-1/t10-,12?;/m1./s1