3-[4-(pyridin-2-ylmethylcarbamoyl)phenyl]propanoic acid

Systemtic Name: 3-[4-(pyridin-2-ylmethylcarbamoyl)phenyl]propanoic acid Openeye Name: 3-[4-(2-pyridylmethylcarbamoyl)phenyl]propanoic acid CAS Name: 3-[4-[oxo-(2-pyridinylmethylamino)methyl]phenyl]propanoic acid IUPAC Name: 3-[4-(pyridin-2-ylmethylcarbamoyl)phenyl]propanoic acid Traditional Name: 3-[4-(2-pyridylmethylcarbamoyl)phenyl]propionic acid Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CNC(=O)C2=CC=C(C=C2)CCC(=O)O

Isomeric SMILES

C1=CC=NC(=C1)CNC(=O)C2=CC=C(C=C2)CCC(=O)O

InChI

InChI=1S/C16H16N2O3/c19-15(20)9-6-12-4-7-13(8-5-12)16(21)18-11-14-3-1-2-10-17-14/h1-5,7-8,10H,6,9,11H2,(H,18,21)(H,19,20)