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2-(2-nitrooxybutanoylamino)-3-sulfanyl-propanoic acid

2-(2-nitrooxybutanoylamino)-3-sulfanyl-propanoic acid

Systemtic Name:2-(2-nitrooxybutanoylamino)-3-sulfanyl-propanoic acid
Openeye Name:2-(2-nitrooxybutanoylamino)-3-sulfanyl-propanoic acid
CAS Name:3-mercapto-2-[(2-nitrooxy-1-oxobutyl)amino]propanoic acid
IUPAC Name:2-(2-nitrooxybutanoylamino)-3-sulfanylpropanoic acid
Traditional Name:3-mercapto-2-(2-nitrooxybutanoylamino)propionic acid
Formula: C7H12N2O6S
MolecularWeight: 252.24498
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C7H12N2O6S/c1-2-5(15-9(13)14)6(10)8-4(3-16)7(11)12/h4-5,16H,2-3H2,1H3,(H,8,10)(H,11,12)


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