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

Systemtic Name: ethyl 2-[(2,2-dimethyl-3-nitrooxy-propanoyl)amino]-3-(2,2-dimethylpropanoylsulfanyl)propanoate Openeye Name: ethyl 2-[(2,2-dimethyl-3-nitrooxy-propanoyl)amino]-3-(2,2-dimethylpropanoylsulfanyl)propanoate CAS Name: 2-[(2,2-dimethyl-3-nitrooxy-1-oxopropyl)amino]-3-[(2,2-dimethyl-1-oxopropyl)thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-[(2,2-dimethyl-3-nitrooxypropanoyl)amino]-3-(2,2-dimethylpropanoylsulfanyl)propanoate Traditional Name: 2-[(2,2-dimethyl-3-nitrooxy-propanoyl)amino]-3-(pivaloylthio)propionic acid ethyl ester Formula: C15H26N2O7S MolecularWeight: 378.44114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H26N2O7S/c1-7-23-11(18)10(8-25-13(20)14(2,3)4)16-12(19)15(5,6)9-24-17(21)22/h10H,7-9H2,1-6H3,(H,16,19)