methyl 2-[2-(4-nitrophenyl)sulfanylethanoylamino]ethanoate

Systemtic Name: methyl 2-[2-(4-nitrophenyl)sulfanylethanoylamino]ethanoate Openeye Name: methyl 2-[[2-(4-nitrophenyl)sulfanylacetyl]amino]acetate CAS Name: 2-[[2-[(4-nitrophenyl)thio]-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-(4-nitrophenyl)sulfanylacetyl]amino]acetate Traditional Name: 2-[[2-[(4-nitrophenyl)thio]acetyl]amino]acetic acid methyl ester Formula: C11H12N2O5S MolecularWeight: 284.28838

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)CSC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CNC(=O)CSC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C11H12N2O5S/c1-18-11(15)6-12-10(14)7-19-9-4-2-8(3-5-9)13(16)17/h2-5H,6-7H2,1H3,(H,12,14)