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

Systemtic Name: 3-[[(2S)-2-(4-oxidanylidenequinazolin-3-yl)propanoyl]amino]propanoate Openeye Name: 3-[[(2S)-2-(4-oxoquinazolin-3-yl)propanoyl]amino]propanoate CAS Name: 3-[[(2S)-1-oxo-2-(4-oxo-3-quinazolinyl)propyl]amino]propanoate IUPAC Name: 3-[[(2S)-2-(4-oxoquinazolin-3-yl)propanoyl]amino]propanoate Traditional Name: 3-[[(2S)-2-(4-ketoquinazolin-3-yl)propanoyl]amino]propionate Formula: C14H14N3O4- MolecularWeight: 288.27866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O4/c1-9(13(20)15-7-6-12(18)19)17-8-16-11-5-3-2-4-10(11)14(17)21/h2-5,8-9H,6-7H2,1H3,(H,15,20)(H,18,19)/p-1/t9-/m0/s1