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

Systemtic Name: ethyl 2-[(E)-C-(2-nitropropan-2-yl)-N-oxidanyl-carbonimidoyl]sulfanylethanoate Openeye Name: ethyl 2-[(E)-N-hydroxy-C-(1-methyl-1-nitro-ethyl)carbonimidoyl]sulfanylacetate CAS Name: 2-[[(1E)-1-hydroxyimino-2-methyl-2-nitropropyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(E)-N-hydroxy-C-(2-nitropropan-2-yl)carbonimidoyl]sulfanylacetate Traditional Name: 2-[(2-methyl-2-nitro-propanehydroximoyl)thio]acetic acid ethyl ester Formula: C8H14N2O5S MolecularWeight: 250.27216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H14N2O5S/c1-4-15-6(11)5-16-7(9-12)8(2,3)10(13)14/h12H,4-5H2,1-3H3/b9-7+