(2S)-1-[3-(4-oxidanylidenequinazolin-3-yl)propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[3-(4-oxidanylidenequinazolin-3-yl)propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[3-(4-oxoquinazolin-3-yl)propanoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[1-oxo-3-(4-oxo-3-quinazolinyl)propyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[3-(4-oxoquinazolin-3-yl)propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[3-(4-ketoquinazolin-3-yl)propanoyl]proline Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCN2C=NC3=CC=CC=C3C2=O)C(=O)O

Isomeric SMILES

C1C[C@H](N(C1)C(=O)CCN2C=NC3=CC=CC=C3C2=O)C(=O)O

InChI

InChI=1S/C16H17N3O4/c20-14(19-8-3-6-13(19)16(22)23)7-9-18-10-17-12-5-2-1-4-11(12)15(18)21/h1-2,4-5,10,13H,3,6-9H2,(H,22,23)/t13-/m0/s1