(2S)-2-[3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoylamino]propanoate

Systemtic Name: (2S)-2-[3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoylamino]propanoate Openeye Name: (2S)-2-[3-(4-oxo-1H-quinazolin-2-yl)propanoylamino]propanoate CAS Name: (2S)-2-[[1-oxo-3-(4-oxo-1H-quinazolin-2-yl)propyl]amino]propanoate IUPAC Name: (2S)-2-[3-(4-oxo-1H-quinazolin-2-yl)propanoylamino]propanoate Traditional Name: (2S)-2-[3-(4-keto-1H-quinazolin-2-yl)propanoylamino]propionate Formula: C14H14N3O4- MolecularWeight: 288.27866

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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

C[C@@H](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)/p-1/t8-/m0/s1