6-[4-[2-(2-acetamidopropanoylamino)propanoylamino]phenyl]-2-oxidanylidene-1H-pyridine-3-carboxylic acid

Systemtic Name: 6-[4-[2-(2-acetamidopropanoylamino)propanoylamino]phenyl]-2-oxidanylidene-1H-pyridine-3-carboxylic acid Openeye Name: 6-[4-[2-(2-acetamidopropanoylamino)propanoylamino]phenyl]-2-oxo-1H-pyridine-3-carboxylic acid CAS Name: 6-[4-[[2-[(2-acetamido-1-oxopropyl)amino]-1-oxopropyl]amino]phenyl]-2-oxo-1H-pyridine-3-carboxylic acid IUPAC Name: 6-[4-[2-(2-acetamidopropanoylamino)propanoylamino]phenyl]-2-oxo-1H-pyridine-3-carboxylic acid Traditional Name: 6-[4-[2-(2-acetamidopropanoylamino)propanoylamino]phenyl]-2-keto-1H-pyridine-3-carboxylic acid Formula: C20H22N4O6 MolecularWeight: 414.41188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)C(=O)NC1=CC=C(C=C1)C2=CC=C(C(=O)N2)C(=O)O)NC(=O)C

Isomeric SMILES

CC(C(=O)NC(C)C(=O)NC1=CC=C(C=C1)C2=CC=C(C(=O)N2)C(=O)O)NC(=O)C

InChI

InChI=1S/C20H22N4O6/c1-10(21-12(3)25)17(26)22-11(2)18(27)23-14-6-4-13(5-7-14)16-9-8-15(20(29)30)19(28)24-16/h4-11H,1-3H3,(H,21,25)(H,22,26)(H,23,27)(H,24,28)(H,29,30)