4-oxidanylidene-4-(pyridin-4-ylmethylcarbamoylamino)butanoic acid

Systemtic Name: 4-oxidanylidene-4-(pyridin-4-ylmethylcarbamoylamino)butanoic acid Openeye Name: 4-oxo-4-(4-pyridylmethylcarbamoylamino)butanoic acid CAS Name: 4-oxo-4-[[oxo-(pyridin-4-ylmethylamino)methyl]amino]butanoic acid IUPAC Name: 4-oxo-4-(pyridin-4-ylmethylcarbamoylamino)butanoic acid Traditional Name: 4-keto-4-(4-pyridylmethylcarbamoylamino)butyric acid Formula: C11H13N3O4 MolecularWeight: 251.23862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1CNC(=O)NC(=O)CCC(=O)O

Isomeric SMILES

C1=CN=CC=C1CNC(=O)NC(=O)CCC(=O)O

InChI

InChI=1S/C11H13N3O4/c15-9(1-2-10(16)17)14-11(18)13-7-8-3-5-12-6-4-8/h3-6H,1-2,7H2,(H,16,17)(H2,13,14,15,18)