[2-oxidanylidene-2-(4-phenylmethoxyphenyl)ethyl] pyridine-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(4-phenylmethoxyphenyl)ethyl] pyridine-4-carboxylate Openeye Name: [2-(4-benzyloxyphenyl)-2-oxo-ethyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [2-oxo-2-(4-phenylmethoxyphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylmethoxyphenyl)ethyl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [2-(4-benzoxyphenyl)-2-keto-ethyl] ester Formula: C21H17NO4 MolecularWeight: 347.36398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)COC(=O)C3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)COC(=O)C3=CC=NC=C3

InChI

InChI=1S/C21H17NO4/c23-20(15-26-21(24)18-10-12-22-13-11-18)17-6-8-19(9-7-17)25-14-16-4-2-1-3-5-16/h1-13H,14-15H2