2-acetamido-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanoic acid

Systemtic Name: 2-acetamido-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanoic acid Openeye Name: 2-acetamido-4-(4-oxo-1H-quinazolin-2-yl)butanoic acid CAS Name: 2-acetamido-4-(4-oxo-1H-quinazolin-2-yl)butanoic acid IUPAC Name: 2-acetamido-4-(4-oxo-1H-quinazolin-2-yl)butanoic acid Traditional Name: 2-acetamido-4-(4-keto-1H-quinazolin-2-yl)butyric acid Formula: C14H15N3O4 MolecularWeight: 289.2866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCC1=NC(=O)C2=CC=CC=C2N1)C(=O)O

Isomeric SMILES

CC(=O)NC(CCC1=NC(=O)C2=CC=CC=C2N1)C(=O)O

InChI

InChI=1S/C14H15N3O4/c1-8(18)15-11(14(20)21)6-7-12-16-10-5-3-2-4-9(10)13(19)17-12/h2-5,11H,6-7H2,1H3,(H,15,18)(H,20,21)(H,16,17,19)