(4-aminocarbonylphenyl)methyl 2-[(4-ethoxyphenyl)amino]pyridine-3-carboxylate

Systemtic Name: (4-aminocarbonylphenyl)methyl 2-[(4-ethoxyphenyl)amino]pyridine-3-carboxylate Openeye Name: (4-carbamoylphenyl)methyl 2-(4-ethoxyanilino)pyridine-3-carboxylate CAS Name: 2-(4-ethoxyanilino)-3-pyridinecarboxylic acid (4-carbamoylphenyl)methyl ester IUPAC Name: (4-carbamoylphenyl)methyl 2-(4-ethoxyanilino)pyridine-3-carboxylate Traditional Name: 2-(p-phenetidino)nicotinic acid (4-carbamoylbenzyl) ester Formula: C22H21N3O4 MolecularWeight: 391.41984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=C(C=CC=N2)C(=O)OCC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=C(C=CC=N2)C(=O)OCC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C22H21N3O4/c1-2-28-18-11-9-17(10-12-18)25-21-19(4-3-13-24-21)22(27)29-14-15-5-7-16(8-6-15)20(23)26/h3-13H,2,14H2,1H3,(H2,23,26)(H,24,25)