ethyl 2-[(2-methyl-2-nitrooxy-propanoyl)amino]-3-sulfanyl-propanoate

Systemtic Name: ethyl 2-[(2-methyl-2-nitrooxy-propanoyl)amino]-3-sulfanyl-propanoate Openeye Name: ethyl 2-[(2-methyl-2-nitrooxy-propanoyl)amino]-3-sulfanyl-propanoate CAS Name: 3-mercapto-2-[(2-methyl-2-nitrooxy-1-oxopropyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 2-[(2-methyl-2-nitrooxypropanoyl)amino]-3-sulfanylpropanoate Traditional Name: 3-mercapto-2-[(2-methyl-2-nitrooxy-propanoyl)amino]propionic acid ethyl ester Formula: C9H16N2O6S MolecularWeight: 280.29814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H16N2O6S/c1-4-16-7(12)6(5-18)10-8(13)9(2,3)17-11(14)15/h6,18H,4-5H2,1-3H3,(H,10,13)