4-oxidanylidene-4-[[4-(4-oxidanylidene-6-pyridin-4-yl-1H-pyrimidin-2-yl)phenyl]methylamino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[4-(4-oxidanylidene-6-pyridin-4-yl-1H-pyrimidin-2-yl)phenyl]methylamino]butanoic acid Openeye Name: 4-oxo-4-[[4-[4-oxo-6-(4-pyridyl)-1H-pyrimidin-2-yl]phenyl]methylamino]butanoic acid CAS Name: 4-oxo-4-[[4-(4-oxo-6-pyridin-4-yl-1H-pyrimidin-2-yl)phenyl]methylamino]butanoic acid IUPAC Name: 4-oxo-4-[[4-(4-oxo-6-pyridin-4-yl-1H-pyrimidin-2-yl)phenyl]methylamino]butanoic acid Traditional Name: 4-keto-4-[[4-[4-keto-6-(4-pyridyl)-1H-pyrimidin-2-yl]benzyl]amino]butyric acid Formula: C20H18N4O4 MolecularWeight: 378.38132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)CCC(=O)O)C2=NC(=O)C=C(N2)C3=CC=NC=C3

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)CCC(=O)O)C2=NC(=O)C=C(N2)C3=CC=NC=C3

InChI

InChI=1S/C20H18N4O4/c25-17(5-6-19(27)28)22-12-13-1-3-15(4-2-13)20-23-16(11-18(26)24-20)14-7-9-21-10-8-14/h1-4,7-11H,5-6,12H2,(H,22,25)(H,27,28)(H,23,24,26)