ethyl 4-[5-(3-oxidanyl-4-oxidanylidene-1,2-dihydroquinazolin-2-yl)furan-2-yl]benzoate

Systemtic Name: ethyl 4-[5-(3-oxidanyl-4-oxidanylidene-1,2-dihydroquinazolin-2-yl)furan-2-yl]benzoate Openeye Name: ethyl 4-[5-(3-hydroxy-4-oxo-1,2-dihydroquinazolin-2-yl)-2-furyl]benzoate CAS Name: 4-[5-(3-hydroxy-4-oxo-1,2-dihydroquinazolin-2-yl)-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-(3-hydroxy-4-oxo-1,2-dihydroquinazolin-2-yl)furan-2-yl]benzoate Traditional Name: 4-[5-(3-hydroxy-4-keto-1,2-dihydroquinazolin-2-yl)-2-furyl]benzoic acid ethyl ester Formula: C21H18N2O5 MolecularWeight: 378.37802

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C3NC4=CC=CC=C4C(=O)N3O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C3NC4=CC=CC=C4C(=O)N3O

InChI

InChI=1S/C21H18N2O5/c1-2-27-21(25)14-9-7-13(8-10-14)17-11-12-18(28-17)19-22-16-6-4-3-5-15(16)20(24)23(19)26/h3-12,19,22,26H,2H2,1H3