2-[[4-[(3-cyano-5-phenyl-pyridin-2-yl)amino]phenyl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[4-[(3-cyano-5-phenyl-pyridin-2-yl)amino]phenyl]carbonylamino]ethanoic acid Openeye Name: 2-[[4-[(3-cyano-5-phenyl-2-pyridyl)amino]benzoyl]amino]acetic acid CAS Name: 2-[[[4-[(3-cyano-5-phenyl-2-pyridinyl)amino]phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[4-[(3-cyano-5-phenylpyridin-2-yl)amino]benzoyl]amino]acetic acid Traditional Name: 2-[[4-[(3-cyano-5-phenyl-2-pyridyl)amino]benzoyl]amino]acetic acid Formula: C21H16N4O3 MolecularWeight: 372.37674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN=C(C(=C2)C#N)NC3=CC=C(C=C3)C(=O)NCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CN=C(C(=C2)C#N)NC3=CC=C(C=C3)C(=O)NCC(=O)O

InChI

InChI=1S/C21H16N4O3/c22-11-16-10-17(14-4-2-1-3-5-14)12-23-20(16)25-18-8-6-15(7-9-18)21(28)24-13-19(26)27/h1-10,12H,13H2,(H,23,25)(H,24,28)(H,26,27)