4-azanyl-5-(5-azanyl-2-cyano-pyridin-3-yl)-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-azanyl-5-(5-azanyl-2-cyano-pyridin-3-yl)-5-oxidanylidene-pentanoic acid Openeye Name: 4-amino-5-(5-amino-2-cyano-3-pyridyl)-5-oxo-pentanoic acid CAS Name: 4-amino-5-(5-amino-2-cyano-3-pyridinyl)-5-oxopentanoic acid IUPAC Name: 4-amino-5-(5-amino-2-cyanopyridin-3-yl)-5-oxopentanoic acid Traditional Name: 4-amino-5-(5-amino-2-cyano-3-pyridyl)-5-keto-valeric acid Formula: C11H12N4O3 MolecularWeight: 248.23798

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=NC=C1N)C#N)C(=O)C(CCC(=O)O)N

Isomeric SMILES

C1=C(C(=NC=C1N)C#N)C(=O)C(CCC(=O)O)N

InChI

InChI=1S/C11H12N4O3/c12-4-9-7(3-6(13)5-15-9)11(18)8(14)1-2-10(16)17/h3,5,8H,1-2,13-14H2,(H,16,17)