4-[2-(4-oxidanylidenequinazolin-3-yl)propanoylamino]butanoic acid

Systemtic Name: 4-[2-(4-oxidanylidenequinazolin-3-yl)propanoylamino]butanoic acid Openeye Name: 4-[2-(4-oxoquinazolin-3-yl)propanoylamino]butanoic acid CAS Name: 4-[[1-oxo-2-(4-oxo-3-quinazolinyl)propyl]amino]butanoic acid IUPAC Name: 4-[2-(4-oxoquinazolin-3-yl)propanoylamino]butanoic acid Traditional Name: 4-[2-(4-ketoquinazolin-3-yl)propanoylamino]butyric acid Formula: C15H17N3O4 MolecularWeight: 303.31318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCCC(=O)O)N1C=NC2=CC=CC=C2C1=O

Isomeric SMILES

CC(C(=O)NCCCC(=O)O)N1C=NC2=CC=CC=C2C1=O

InChI

InChI=1S/C15H17N3O4/c1-10(14(21)16-8-4-7-13(19)20)18-9-17-12-6-3-2-5-11(12)15(18)22/h2-3,5-6,9-10H,4,7-8H2,1H3,(H,16,21)(H,19,20)