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ethyl 3-ethanoylsulfanyl-2-(2-nitrooxybutanoylamino)propanoate

ethyl 3-ethanoylsulfanyl-2-(2-nitrooxybutanoylamino)propanoate

Systemtic Name:ethyl 3-ethanoylsulfanyl-2-(2-nitrooxybutanoylamino)propanoate
Openeye Name:ethyl 3-acetylsulfanyl-2-(2-nitrooxybutanoylamino)propanoate
CAS Name:3-(acetylthio)-2-[(2-nitrooxy-1-oxobutyl)amino]propanoic acid ethyl ester
IUPAC Name:ethyl 3-acetylsulfanyl-2-(2-nitrooxybutanoylamino)propanoate
Traditional Name:3-(acetylthio)-2-(2-nitrooxybutanoylamino)propionic acid ethyl ester
Formula: C11H18N2O7S
MolecularWeight: 322.33482
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC(CSC(=O)C)C(=O)OCC)O[N+](=O)[O-]


Isomeric SMILES

CCC(C(=O)NC(CSC(=O)C)C(=O)OCC)O[N+](=O)[O-]


InChI

InChI=1S/C11H18N2O7S/c1-4-9(20-13(17)18)10(15)12-8(6-21-7(3)14)11(16)19-5-2/h8-9H,4-6H2,1-3H3,(H,12,15)


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