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

Systemtic Name: ethyl 3-(2,2-dimethyl-3-nitrooxy-propanoyl)sulfanyl-2-[(2-methyl-2-nitrooxy-propanoyl)amino]propanoate Openeye Name: ethyl 3-(2,2-dimethyl-3-nitrooxy-propanoyl)sulfanyl-2-[(2-methyl-2-nitrooxy-propanoyl)amino]propanoate CAS Name: 3-[(2,2-dimethyl-3-nitrooxy-1-oxopropyl)thio]-2-[(2-methyl-2-nitrooxy-1-oxopropyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-(2,2-dimethyl-3-nitrooxypropanoyl)sulfanyl-2-[(2-methyl-2-nitrooxypropanoyl)amino]propanoate Traditional Name: 3-[(2,2-dimethyl-3-nitrooxy-propanoyl)thio]-2-[(2-methyl-2-nitrooxy-propanoyl)amino]propionic acid ethyl ester Formula: C14H23N3O10S MolecularWeight: 425.41152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23N3O10S/c1-6-25-10(18)9(15-11(19)14(4,5)27-17(23)24)7-28-12(20)13(2,3)8-26-16(21)22/h9H,6-8H2,1-5H3,(H,15,19)