4-azanyl-4-oxidanylidene-3-(quinolin-2-ylcarbonylamino)butanoic acid

Systemtic Name: 4-azanyl-4-oxidanylidene-3-(quinolin-2-ylcarbonylamino)butanoic acid Openeye Name: 4-amino-4-oxo-3-(quinoline-2-carbonylamino)butanoic acid CAS Name: 4-amino-4-oxo-3-[[oxo(2-quinolinyl)methyl]amino]butanoic acid IUPAC Name: 4-amino-4-oxo-3-(quinoline-2-carbonylamino)butanoic acid Traditional Name: 4-amino-4-keto-3-(quinaldoylamino)butyric acid Formula: C14H13N3O4 MolecularWeight: 287.27072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C(=O)NC(CC(=O)O)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C(=O)NC(CC(=O)O)C(=O)N

InChI

InChI=1S/C14H13N3O4/c15-13(20)11(7-12(18)19)17-14(21)10-6-5-8-3-1-2-4-9(8)16-10/h1-6,11H,7H2,(H2,15,20)(H,17,21)(H,18,19)