5-fluoranyl-3-[[(2S)-2-(6-methoxy-4-oxidanylidene-quinazolin-3-yl)butanoyl]amino]-4-oxidanylidene-pentanoic acid

Systemtic Name: 5-fluoranyl-3-[[(2S)-2-(6-methoxy-4-oxidanylidene-quinazolin-3-yl)butanoyl]amino]-4-oxidanylidene-pentanoic acid Openeye Name: 5-fluoro-3-[[(2S)-2-(6-methoxy-4-oxo-quinazolin-3-yl)butanoyl]amino]-4-oxo-pentanoic acid CAS Name: 5-fluoro-3-[[(2S)-2-(6-methoxy-4-oxo-3-quinazolinyl)-1-oxobutyl]amino]-4-oxopentanoic acid IUPAC Name: 5-fluoro-3-[[(2S)-2-(6-methoxy-4-oxoquinazolin-3-yl)butanoyl]amino]-4-oxopentanoic acid Traditional Name: 5-fluoro-4-keto-3-[[(2S)-2-(4-keto-6-methoxy-quinazolin-3-yl)butanoyl]amino]valeric acid Formula: C18H20FN3O6 MolecularWeight: 393.366303

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC(CC(=O)O)C(=O)CF)N1C=NC2=C(C1=O)C=C(C=C2)OC

Isomeric SMILES

CC[C@@H](C(=O)NC(CC(=O)O)C(=O)CF)N1C=NC2=C(C1=O)C=C(C=C2)OC

InChI

InChI=1S/C18H20FN3O6/c1-3-14(17(26)21-13(7-16(24)25)15(23)8-19)22-9-20-12-5-4-10(28-2)6-11(12)18(22)27/h4-6,9,13-14H,3,7-8H2,1-2H3,(H,21,26)(H,24,25)/t13?,14-/m0/s1