2-[methyl-[2-(4-nitrophenyl)sulfanylethanoyl]amino]ethanoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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