3-[(5-nitrothiophen-2-yl)carbonylamino]propanoic acid

Systemtic Name: 3-[(5-nitrothiophen-2-yl)carbonylamino]propanoic acid Openeye Name: 3-[(5-nitrothiophene-2-carbonyl)amino]propanoic acid CAS Name: 3-[[(5-nitro-2-thiophenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-[(5-nitrothiophene-2-carbonyl)amino]propanoic acid Traditional Name: 3-[(5-nitrothiophene-2-carbonyl)amino]propionic acid Formula: C8H8N2O5S MolecularWeight: 244.22452

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)[N+](=O)[O-])C(=O)NCCC(=O)O

Isomeric SMILES

C1=C(SC(=C1)[N+](=O)[O-])C(=O)NCCC(=O)O

InChI

InChI=1S/C8H8N2O5S/c11-7(12)3-4-9-8(13)5-1-2-6(16-5)10(14)15/h1-2H,3-4H2,(H,9,13)(H,11,12)