2-acetamido-3-(5-nitropyridin-2-yl)sulfanyl-propanoic acid

Systemtic Name: 2-acetamido-3-(5-nitropyridin-2-yl)sulfanyl-propanoic acid Openeye Name: 2-acetamido-3-[(5-nitro-2-pyridyl)sulfanyl]propanoic acid CAS Name: 2-acetamido-3-[(5-nitro-2-pyridinyl)thio]propanoic acid IUPAC Name: 2-acetamido-3-(5-nitropyridin-2-yl)sulfanylpropanoic acid Traditional Name: 2-acetamido-3-[(5-nitro-2-pyridyl)thio]propionic acid Formula: C10H11N3O5S MolecularWeight: 285.27644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11N3O5S/c1-6(14)12-8(10(15)16)5-19-9-3-2-7(4-11-9)13(17)18/h2-4,8H,5H2,1H3,(H,12,14)(H,15,16)