3-(3-phenylmethoxy-1-pyridin-2-yl-propyl)benzoic acid

Systemtic Name: 3-(3-phenylmethoxy-1-pyridin-2-yl-propyl)benzoic acid Openeye Name: 3-[3-benzyloxy-1-(2-pyridyl)propyl]benzoic acid CAS Name: 3-[3-phenylmethoxy-1-(2-pyridinyl)propyl]benzoic acid IUPAC Name: 3-(3-phenylmethoxy-1-pyridin-2-ylpropyl)benzoic acid Traditional Name: 3-[3-benzoxy-1-(2-pyridyl)propyl]benzoic acid Formula: C22H21NO3 MolecularWeight: 347.40704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCC(C2=CC=CC(=C2)C(=O)O)C3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)COCCC(C2=CC=CC(=C2)C(=O)O)C3=CC=CC=N3

InChI

InChI=1S/C22H21NO3/c24-22(25)19-10-6-9-18(15-19)20(21-11-4-5-13-23-21)12-14-26-16-17-7-2-1-3-8-17/h1-11,13,15,20H,12,14,16H2,(H,24,25)