(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(3-nitropyridin-2-yl)disulfanyl]propanoate

Systemtic Name: (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(3-nitropyridin-2-yl)disulfanyl]propanoate Openeye Name: (2R)-2-(tert-butoxycarbonylamino)-3-[(3-nitro-2-pyridyl)disulfanyl]propanoate CAS Name: (2R)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[(3-nitro-2-pyridinyl)disulfanyl]propanoate IUPAC Name: (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(3-nitropyridin-2-yl)disulfanyl]propanoate Traditional Name: (2R)-2-(tert-butoxycarbonylamino)-3-[(3-nitro-2-pyridyl)disulfanyl]propionate Formula: C13H16N3O6S2- MolecularWeight: 374.41264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CSSC1=C(C=CC=N1)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CSSC1=C(C=CC=N1)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C13H17N3O6S2/c1-13(2,3)22-12(19)15-8(11(17)18)7-23-24-10-9(16(20)21)5-4-6-14-10/h4-6,8H,7H2,1-3H3,(H,15,19)(H,17,18)/p-1/t8-/m0/s1