2-[3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoylamino]propanoic acid

Systemtic Name: 2-[3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoylamino]propanoic acid Openeye Name: 2-[3-(4-oxo-1H-quinazolin-2-yl)propanoylamino]propanoic acid CAS Name: 2-[[1-oxo-3-(4-oxo-1H-quinazolin-2-yl)propyl]amino]propanoic acid IUPAC Name: 2-[3-(4-oxo-1H-quinazolin-2-yl)propanoylamino]propanoic acid Traditional Name: 2-[3-(4-keto-1H-quinazolin-2-yl)propanoylamino]propionic acid Formula: C14H15N3O4 MolecularWeight: 289.2866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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