5-(3-cyanophenoxy)-4-[(4-cyanophenyl)carbonylamino]pentanoic acid

Systemtic Name: 5-(3-cyanophenoxy)-4-[(4-cyanophenyl)carbonylamino]pentanoic acid Openeye Name: 4-[(4-cyanobenzoyl)amino]-5-(3-cyanophenoxy)pentanoic acid CAS Name: 5-(3-cyanophenoxy)-4-[[(4-cyanophenyl)-oxomethyl]amino]pentanoic acid IUPAC Name: 4-[(4-cyanobenzoyl)amino]-5-(3-cyanophenoxy)pentanoic acid Traditional Name: 4-[(4-cyanobenzoyl)amino]-5-(3-cyanophenoxy)valeric acid Formula: C20H17N3O4 MolecularWeight: 363.36668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC(CCC(=O)O)NC(=O)C2=CC=C(C=C2)C#N)C#N

Isomeric SMILES

C1=CC(=CC(=C1)OCC(CCC(=O)O)NC(=O)C2=CC=C(C=C2)C#N)C#N

InChI

InChI=1S/C20H17N3O4/c21-11-14-4-6-16(7-5-14)20(26)23-17(8-9-19(24)25)13-27-18-3-1-2-15(10-18)12-22/h1-7,10,17H,8-9,13H2,(H,23,26)(H,24,25)