2-(5-nitrothiophen-3-yl)propanedioic acid

Systemtic Name: 2-(5-nitrothiophen-3-yl)propanedioic acid Openeye Name: 2-(5-nitro-3-thienyl)propanedioic acid CAS Name: 2-(5-nitro-3-thiophenyl)propanedioic acid IUPAC Name: 2-(5-nitrothiophen-3-yl)propanedioic acid Traditional Name: 2-(5-nitro-3-thienyl)malonic acid Formula: C7H5NO6S MolecularWeight: 231.1827

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC=C1C(C(=O)O)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=C(SC=C1C(C(=O)O)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C7H5NO6S/c9-6(10)5(7(11)12)3-1-4(8(13)14)15-2-3/h1-2,5H,(H,9,10)(H,11,12)