2-[4-[(3-oxidanylpyridin-2-yl)methyl]phenyl]ethyl benzoate

Systemtic Name: 2-[4-[(3-oxidanylpyridin-2-yl)methyl]phenyl]ethyl benzoate Openeye Name: 2-[4-[(3-hydroxy-2-pyridyl)methyl]phenyl]ethyl benzoate CAS Name: benzoic acid 2-[4-[(3-hydroxy-2-pyridinyl)methyl]phenyl]ethyl ester IUPAC Name: 2-[4-[(3-hydroxypyridin-2-yl)methyl]phenyl]ethyl benzoate Traditional Name: benzoic acid 2-[4-[(3-hydroxy-2-pyridyl)methyl]phenyl]ethyl ester Formula: C21H19NO3 MolecularWeight: 333.38046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCC2=CC=C(C=C2)CC3=C(C=CC=N3)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCC2=CC=C(C=C2)CC3=C(C=CC=N3)O

InChI

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