4-[2-(2-phenylmethoxypyridin-3-yl)ethyl]benzoic acid

Systemtic Name: 4-[2-(2-phenylmethoxypyridin-3-yl)ethyl]benzoic acid Openeye Name: 4-[2-(2-benzyloxy-3-pyridyl)ethyl]benzoic acid CAS Name: 4-[2-(2-phenylmethoxy-3-pyridinyl)ethyl]benzoic acid IUPAC Name: 4-[2-(2-phenylmethoxypyridin-3-yl)ethyl]benzoic acid Traditional Name: 4-[2-(2-benzoxy-3-pyridyl)ethyl]benzoic acid Formula: C21H19NO3 MolecularWeight: 333.38046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=CC=N2)CCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=CC=N2)CCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C21H19NO3/c23-21(24)19-12-9-16(10-13-19)8-11-18-7-4-14-22-20(18)25-15-17-5-2-1-3-6-17/h1-7,9-10,12-14H,8,11,15H2,(H,23,24)