3-[4-(5-cyanopyridin-2-yl)-2-oxidanyl-phenoxy]propanoic acid

Systemtic Name: 3-[4-(5-cyanopyridin-2-yl)-2-oxidanyl-phenoxy]propanoic acid Openeye Name: 3-[4-(5-cyano-2-pyridyl)-2-hydroxy-phenoxy]propanoic acid CAS Name: 3-[4-(5-cyano-2-pyridinyl)-2-hydroxyphenoxy]propanoic acid IUPAC Name: 3-[4-(5-cyanopyridin-2-yl)-2-hydroxyphenoxy]propanoic acid Traditional Name: 3-[4-(5-cyano-2-pyridyl)-2-hydroxy-phenoxy]propionic acid Formula: C15H12N2O4 MolecularWeight: 284.26678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=NC=C(C=C2)C#N)O)OCCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C2=NC=C(C=C2)C#N)O)OCCC(=O)O

InChI

InChI=1S/C15H12N2O4/c16-8-10-1-3-12(17-9-10)11-2-4-14(13(18)7-11)21-6-5-15(19)20/h1-4,7,9,18H,5-6H2,(H,19,20)