methyl 3-[2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 3-[2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]-3-phenyl-propanoate Openeye Name: methyl 3-[[2-(6-fluoro-4-oxo-quinazolin-3-yl)acetyl]amino]-3-phenyl-propanoate CAS Name: 3-[[2-(6-fluoro-4-oxo-3-quinazolinyl)-1-oxoethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-[[2-(6-fluoro-4-oxoquinazolin-3-yl)acetyl]amino]-3-phenylpropanoate Traditional Name: 3-[[2-(6-fluoro-4-keto-quinazolin-3-yl)acetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C20H18FN3O4 MolecularWeight: 383.373023

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)F

Isomeric SMILES

COC(=O)CC(C1=CC=CC=C1)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)F

InChI

InChI=1S/C20H18FN3O4/c1-28-19(26)10-17(13-5-3-2-4-6-13)23-18(25)11-24-12-22-16-8-7-14(21)9-15(16)20(24)27/h2-9,12,17H,10-11H2,1H3,(H,23,25)