2-[(5-nitrothiophen-2-yl)carbonylamino]propanoic acid

Systemtic Name: 2-[(5-nitrothiophen-2-yl)carbonylamino]propanoic acid Openeye Name: 2-[(5-nitrothiophene-2-carbonyl)amino]propanoic acid CAS Name: 2-[[(5-nitro-2-thiophenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 2-[(5-nitrothiophene-2-carbonyl)amino]propanoic acid Traditional Name: 2-[(5-nitrothiophene-2-carbonyl)amino]propionic acid Formula: C8H8N2O5S MolecularWeight: 244.22452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C1=CC=C(S1)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)O)NC(=O)C1=CC=C(S1)[N+](=O)[O-]

InChI

InChI=1S/C8H8N2O5S/c1-4(8(12)13)9-7(11)5-2-3-6(16-5)10(14)15/h2-4H,1H3,(H,9,11)(H,12,13)