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

Systemtic Name: 2-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)ethanoic acid Openeye Name: 2-[3,5-bis(3-pyridyl)-1,2,4-triazol-1-yl]acetic acid CAS Name: 2-[3,5-bis(3-pyridinyl)-1,2,4-triazol-1-yl]acetic acid IUPAC Name: 2-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)acetic acid Traditional Name: 2-[3,5-bis(3-pyridyl)-1,2,4-triazol-1-yl]acetic acid Formula: C14H11N5O2 MolecularWeight: 281.26944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NN(C(=N2)C3=CN=CC=C3)CC(=O)O

Isomeric SMILES

C1=CC(=CN=C1)C2=NN(C(=N2)C3=CN=CC=C3)CC(=O)O

InChI

InChI=1S/C14H11N5O2/c20-12(21)9-19-14(11-4-2-6-16-8-11)17-13(18-19)10-3-1-5-15-7-10/h1-8H,9H2,(H,20,21)