methyl 2-[2-(4-oxidanylidenequinazolin-3-yl)ethanoyloxymethyl]-4-phenyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[2-(4-oxidanylidenequinazolin-3-yl)ethanoyloxymethyl]-4-phenyl-quinoline-3-carboxylate Openeye Name: methyl 2-[[2-(4-oxoquinazolin-3-yl)acetyl]oxymethyl]-4-phenyl-quinoline-3-carboxylate CAS Name: 2-[[1-oxo-2-(4-oxo-3-quinazolinyl)ethoxy]methyl]-4-phenyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(4-oxoquinazolin-3-yl)acetyl]oxymethyl]-4-phenylquinoline-3-carboxylate Traditional Name: 2-[[2-(4-ketoquinazolin-3-yl)acetyl]oxymethyl]-4-phenyl-quinoline-3-carboxylic acid methyl ester Formula: C28H21N3O5 MolecularWeight: 479.48344

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)CN3C=NC4=CC=CC=C4C3=O)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)CN3C=NC4=CC=CC=C4C3=O)C5=CC=CC=C5

InChI

InChI=1S/C28H21N3O5/c1-35-28(34)26-23(30-22-14-8-5-11-19(22)25(26)18-9-3-2-4-10-18)16-36-24(32)15-31-17-29-21-13-7-6-12-20(21)27(31)33/h2-14,17H,15-16H2,1H3