ethyl 2-[(E)-C-(2-nitropropan-2-yl)-N-oxidanyl-carbonimidoyl]sulfanylpropanoate

Systemtic Name: ethyl 2-[(E)-C-(2-nitropropan-2-yl)-N-oxidanyl-carbonimidoyl]sulfanylpropanoate Openeye Name: ethyl 2-[(E)-N-hydroxy-C-(1-methyl-1-nitro-ethyl)carbonimidoyl]sulfanylpropanoate CAS Name: 2-[[(1E)-1-hydroxyimino-2-methyl-2-nitropropyl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-[(E)-N-hydroxy-C-(2-nitropropan-2-yl)carbonimidoyl]sulfanylpropanoate Traditional Name: 2-[(2-methyl-2-nitro-propanehydroximoyl)thio]propionic acid ethyl ester Formula: C9H16N2O5S MolecularWeight: 264.29874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)SC(=NO)C(C)(C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(C)S/C(=N/O)/C(C)(C)[N+](=O)[O-]

InChI

InChI=1S/C9H16N2O5S/c1-5-16-7(12)6(2)17-8(10-13)9(3,4)11(14)15/h6,13H,5H2,1-4H3/b10-8+