3-[(3-carboxyphenyl)carbamoyl]pyrazine-2-carboxylic acid

Systemtic Name: 3-[(3-carboxyphenyl)carbamoyl]pyrazine-2-carboxylic acid Openeye Name: 3-[(3-carboxyphenyl)carbamoyl]pyrazine-2-carboxylic acid CAS Name: 3-[(3-carboxyanilino)-oxomethyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-[(3-carboxyphenyl)carbamoyl]pyrazine-2-carboxylic acid Traditional Name: 3-[(3-carboxyphenyl)carbamoyl]pyrazinoic acid Formula: C13H9N3O5 MolecularWeight: 287.22766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=NC=CN=C2C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=NC=CN=C2C(=O)O)C(=O)O

InChI

InChI=1S/C13H9N3O5/c17-11(9-10(13(20)21)15-5-4-14-9)16-8-3-1-2-7(6-8)12(18)19/h1-6H,(H,16,17)(H,18,19)(H,20,21)