methyl 2-[methyl-[2-(4-nitrophenyl)sulfanylethanoyl]amino]ethanoate

Systemtic Name: methyl 2-[methyl-[2-(4-nitrophenyl)sulfanylethanoyl]amino]ethanoate Openeye Name: methyl 2-[methyl-[2-(4-nitrophenyl)sulfanylacetyl]amino]acetate CAS Name: 2-[methyl-[2-[(4-nitrophenyl)thio]-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[methyl-[2-(4-nitrophenyl)sulfanylacetyl]amino]acetate Traditional Name: 2-[methyl-[2-[(4-nitrophenyl)thio]acetyl]amino]acetic acid methyl ester Formula: C12H14N2O5S MolecularWeight: 298.31496

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OC)C(=O)CSC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CN(CC(=O)OC)C(=O)CSC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O5S/c1-13(7-12(16)19-2)11(15)8-20-10-5-3-9(4-6-10)14(17)18/h3-6H,7-8H2,1-2H3