3-[[6-(1,2,4-triazol-1-yl)pyridin-3-yl]carbonylamino]butanoic acid

Systemtic Name: 3-[[6-(1,2,4-triazol-1-yl)pyridin-3-yl]carbonylamino]butanoic acid Openeye Name: 3-[[6-(1,2,4-triazol-1-yl)pyridine-3-carbonyl]amino]butanoic acid CAS Name: 3-[[oxo-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]methyl]amino]butanoic acid IUPAC Name: 3-[[6-(1,2,4-triazol-1-yl)pyridine-3-carbonyl]amino]butanoic acid Traditional Name: 3-[[6-(1,2,4-triazol-1-yl)nicotinoyl]amino]butyric acid Formula: C12H13N5O3 MolecularWeight: 275.26332

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NC(=O)C1=CN=C(C=C1)N2C=NC=N2

Isomeric SMILES

CC(CC(=O)O)NC(=O)C1=CN=C(C=C1)N2C=NC=N2

InChI

InChI=1S/C12H13N5O3/c1-8(4-11(18)19)16-12(20)9-2-3-10(14-5-9)17-7-13-6-15-17/h2-3,5-8H,4H2,1H3,(H,16,20)(H,18,19)