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3-(6-cyanopyridin-3-yl)benzoic acid

3-(6-cyanopyridin-3-yl)benzoic acid

Systemtic Name:3-(6-cyanopyridin-3-yl)benzoic acid
Openeye Name:3-(6-cyano-3-pyridyl)benzoic acid
CAS Name:3-(6-cyano-3-pyridinyl)benzoic acid
IUPAC Name:3-(6-cyanopyridin-3-yl)benzoic acid
Traditional Name:3-(6-cyano-3-pyridyl)benzoic acid
Formula: C13H8N2O2
MolecularWeight: 224.21482
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)O)C2=CN=C(C=C2)C#N


Isomeric SMILES

C1=CC(=CC(=C1)C(=O)O)C2=CN=C(C=C2)C#N


InChI

InChI=1S/C13H8N2O2/c14-7-12-5-4-11(8-15-12)9-2-1-3-10(6-9)13(16)17/h1-6,8H,(H,16,17)


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