methyl 2-[3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoyloxymethyl]-4-phenyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoyloxymethyl]-4-phenyl-quinoline-3-carboxylate Openeye Name: methyl 2-[3-(4-oxo-1H-quinazolin-2-yl)propanoyloxymethyl]-4-phenyl-quinoline-3-carboxylate CAS Name: 2-[[1-oxo-3-(4-oxo-1H-quinazolin-2-yl)propoxy]methyl]-4-phenyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-(4-oxo-1H-quinazolin-2-yl)propanoyloxymethyl]-4-phenylquinoline-3-carboxylate Traditional Name: 2-[3-(4-keto-1H-quinazolin-2-yl)propanoyloxymethyl]-4-phenyl-quinoline-3-carboxylic acid methyl ester Formula: C29H23N3O5 MolecularWeight: 493.51002

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)CCC3=NC(=O)C4=CC=CC=C4N3)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)CCC3=NC(=O)C4=CC=CC=C4N3)C5=CC=CC=C5

InChI

InChI=1S/C29H23N3O5/c1-36-29(35)27-23(30-21-13-7-5-11-19(21)26(27)18-9-3-2-4-10-18)17-37-25(33)16-15-24-31-22-14-8-6-12-20(22)28(34)32-24/h2-14H,15-17H2,1H3,(H,31,32,34)