3-[4-(1-pyridin-2-ylethyl)phenyl]propanoic acid

Systemtic Name: 3-[4-(1-pyridin-2-ylethyl)phenyl]propanoic acid Openeye Name: 3-[4-[1-(2-pyridyl)ethyl]phenyl]propanoic acid CAS Name: 3-[4-[1-(2-pyridinyl)ethyl]phenyl]propanoic acid IUPAC Name: 3-[4-(1-pyridin-2-ylethyl)phenyl]propanoic acid Traditional Name: 3-[4-[1-(2-pyridyl)ethyl]phenyl]propionic acid Formula: C16H17NO2 MolecularWeight: 255.31168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)CCC(=O)O)C2=CC=CC=N2

Isomeric SMILES

CC(C1=CC=C(C=C1)CCC(=O)O)C2=CC=CC=N2

InChI

InChI=1S/C16H17NO2/c1-12(15-4-2-3-11-17-15)14-8-5-13(6-9-14)7-10-16(18)19/h2-6,8-9,11-12H,7,10H2,1H3,(H,18,19)