5-[3,6-bis(azanyl)-5-(5-carboxypyridin-2-yl)pyrazin-2-yl]pyrimidine-2-carboxylic acid

Systemtic Name: 5-[3,6-bis(azanyl)-5-(5-carboxypyridin-2-yl)pyrazin-2-yl]pyrimidine-2-carboxylic acid Openeye Name: 5-[3,6-diamino-5-(5-carboxy-2-pyridyl)pyrazin-2-yl]pyrimidine-2-carboxylic acid CAS Name: 5-[3,6-diamino-5-(5-carboxy-2-pyridinyl)-2-pyrazinyl]-2-pyrimidinecarboxylic acid IUPAC Name: 5-[3,6-diamino-5-(5-carboxypyridin-2-yl)pyrazin-2-yl]pyrimidine-2-carboxylic acid Traditional Name: 5-[3,6-diamino-5-(5-carboxy-2-pyridyl)pyrazin-2-yl]pyrimidine-2-carboxylic acid Formula: C15H11N7O4 MolecularWeight: 353.29234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1C(=O)O)C2=NC(=C(N=C2N)C3=CN=C(N=C3)C(=O)O)N

Isomeric SMILES

C1=CC(=NC=C1C(=O)O)C2=NC(=C(N=C2N)C3=CN=C(N=C3)C(=O)O)N

InChI

InChI=1S/C15H11N7O4/c16-11-9(7-4-19-13(15(25)26)20-5-7)21-12(17)10(22-11)8-2-1-6(3-18-8)14(23)24/h1-5H,(H2,16,22)(H2,17,21)(H,23,24)(H,25,26)