2-[[(2S)-2-(4-oxidanylidenequinazolin-3-yl)propanoyl]amino]ethanoate

Systemtic Name: 2-[[(2S)-2-(4-oxidanylidenequinazolin-3-yl)propanoyl]amino]ethanoate Openeye Name: 2-[[(2S)-2-(4-oxoquinazolin-3-yl)propanoyl]amino]acetate CAS Name: 2-[[(2S)-1-oxo-2-(4-oxo-3-quinazolinyl)propyl]amino]acetate IUPAC Name: 2-[[(2S)-2-(4-oxoquinazolin-3-yl)propanoyl]amino]acetate Traditional Name: 2-[[(2S)-2-(4-ketoquinazolin-3-yl)propanoyl]amino]acetate Formula: C13H12N3O4- MolecularWeight: 274.25208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC(=O)[O-])N1C=NC2=CC=CC=C2C1=O

Isomeric SMILES

C[C@@H](C(=O)NCC(=O)[O-])N1C=NC2=CC=CC=C2C1=O

InChI

InChI=1S/C13H13N3O4/c1-8(12(19)14-6-11(17)18)16-7-15-10-5-3-2-4-9(10)13(16)20/h2-5,7-8H,6H2,1H3,(H,14,19)(H,17,18)/p-1/t8-/m0/s1