2-[4-(3-pyridin-3-ylpropanoylamino)phenyl]ethanoic acid

Systemtic Name: 2-[4-(3-pyridin-3-ylpropanoylamino)phenyl]ethanoic acid Openeye Name: 2-[4-[3-(3-pyridyl)propanoylamino]phenyl]acetic acid CAS Name: 2-[4-[[1-oxo-3-(3-pyridinyl)propyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-(3-pyridin-3-ylpropanoylamino)phenyl]acetic acid Traditional Name: 2-[4-[3-(3-pyridyl)propanoylamino]phenyl]acetic acid Formula: C16H16N2O3 MolecularWeight: 284.30984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CCC(=O)NC2=CC=C(C=C2)CC(=O)O

Isomeric SMILES

C1=CC(=CN=C1)CCC(=O)NC2=CC=C(C=C2)CC(=O)O

InChI

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