3-(3,5-dipyridin-4-yl-1,2,4-triazol-1-yl)propanoic acid

Systemtic Name: 3-(3,5-dipyridin-4-yl-1,2,4-triazol-1-yl)propanoic acid Openeye Name: 3-[3,5-bis(4-pyridyl)-1,2,4-triazol-1-yl]propanoic acid CAS Name: 3-(3,5-dipyridin-4-yl-1,2,4-triazol-1-yl)propanoic acid IUPAC Name: 3-(3,5-dipyridin-4-yl-1,2,4-triazol-1-yl)propanoic acid Traditional Name: 3-[3,5-bis(4-pyridyl)-1,2,4-triazol-1-yl]propionic acid Formula: C15H13N5O2 MolecularWeight: 295.29602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1C2=NN(C(=N2)C3=CC=NC=C3)CCC(=O)O

Isomeric SMILES

C1=CN=CC=C1C2=NN(C(=N2)C3=CC=NC=C3)CCC(=O)O

InChI

InChI=1S/C15H13N5O2/c21-13(22)5-10-20-15(12-3-8-17-9-4-12)18-14(19-20)11-1-6-16-7-2-11/h1-4,6-9H,5,10H2,(H,21,22)