3-[(3-oxidanylidene-1H-2-benzofuran-5-yl)carbamoyl]pyrazine-2-carboxylic acid

Systemtic Name: 3-[(3-oxidanylidene-1H-2-benzofuran-5-yl)carbamoyl]pyrazine-2-carboxylic acid Openeye Name: 3-[(3-oxo-1H-isobenzofuran-5-yl)carbamoyl]pyrazine-2-carboxylic acid CAS Name: 3-[oxo-[(3-oxo-1H-isobenzofuran-5-yl)amino]methyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-[(3-oxo-1H-2-benzofuran-5-yl)carbamoyl]pyrazine-2-carboxylic acid Traditional Name: 3-[(3-ketophthalan-5-yl)carbamoyl]pyrazinoic acid Formula: C14H9N3O5 MolecularWeight: 299.23836

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)NC(=O)C3=NC=CN=C3C(=O)O)C(=O)O1

Isomeric SMILES

C1C2=C(C=C(C=C2)NC(=O)C3=NC=CN=C3C(=O)O)C(=O)O1

InChI

InChI=1S/C14H9N3O5/c18-12(10-11(13(19)20)16-4-3-15-10)17-8-2-1-7-6-22-14(21)9(7)5-8/h1-5H,6H2,(H,17,18)(H,19,20)