5-fluoranyl-4-oxidanylidene-3-[[(2S)-2-(4-oxidanylidenequinazolin-3-yl)propanoyl]amino]pentanoic acid

Systemtic Name: 5-fluoranyl-4-oxidanylidene-3-[[(2S)-2-(4-oxidanylidenequinazolin-3-yl)propanoyl]amino]pentanoic acid Openeye Name: 5-fluoro-4-oxo-3-[[(2S)-2-(4-oxoquinazolin-3-yl)propanoyl]amino]pentanoic acid CAS Name: 5-fluoro-4-oxo-3-[[(2S)-1-oxo-2-(4-oxo-3-quinazolinyl)propyl]amino]pentanoic acid IUPAC Name: 5-fluoro-4-oxo-3-[[(2S)-2-(4-oxoquinazolin-3-yl)propanoyl]amino]pentanoic acid Traditional Name: 5-fluoro-4-keto-3-[[(2S)-2-(4-ketoquinazolin-3-yl)propanoyl]amino]valeric acid Formula: C16H16FN3O5 MolecularWeight: 349.313743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC(=O)O)C(=O)CF)N1C=NC2=CC=CC=C2C1=O

Isomeric SMILES

C[C@@H](C(=O)NC(CC(=O)O)C(=O)CF)N1C=NC2=CC=CC=C2C1=O

InChI

InChI=1S/C16H16FN3O5/c1-9(15(24)19-12(6-14(22)23)13(21)7-17)20-8-18-11-5-3-2-4-10(11)16(20)25/h2-5,8-9,12H,6-7H2,1H3,(H,19,24)(H,22,23)/t9-,12?/m0/s1