ethyl 3-butanoylsulfanyl-2-[(2,2-dimethyl-3-nitrooxy-propanoyl)amino]propanoate

Systemtic Name: ethyl 3-butanoylsulfanyl-2-[(2,2-dimethyl-3-nitrooxy-propanoyl)amino]propanoate Openeye Name: ethyl 3-butanoylsulfanyl-2-[(2,2-dimethyl-3-nitrooxy-propanoyl)amino]propanoate CAS Name: 2-[(2,2-dimethyl-3-nitrooxy-1-oxopropyl)amino]-3-(1-oxobutylthio)propanoic acid ethyl ester IUPAC Name: ethyl 3-butanoylsulfanyl-2-[(2,2-dimethyl-3-nitrooxypropanoyl)amino]propanoate Traditional Name: 3-(butyrylthio)-2-[(2,2-dimethyl-3-nitrooxy-propanoyl)amino]propionic acid ethyl ester Formula: C14H24N2O7S MolecularWeight: 364.41456

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)SCC(C(=O)OCC)NC(=O)C(C)(C)CO[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)SCC(C(=O)OCC)NC(=O)C(C)(C)CO[N+](=O)[O-]

InChI

InChI=1S/C14H24N2O7S/c1-5-7-11(17)24-8-10(12(18)22-6-2)15-13(19)14(3,4)9-23-16(20)21/h10H,5-9H2,1-4H3,(H,15,19)