1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxidanylidene-butanoate

Systemtic Name: 1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxidanylidene-butanoate Openeye Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-butanoate CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxobutanoic acid 1-(4-oxo-1H-quinazolin-2-yl)ethyl ester IUPAC Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxobutanoate Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-keto-butyric acid 1-(4-keto-1H-quinazolin-2-yl)ethyl ester Formula: C22H20N2O6 MolecularWeight: 408.404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)CCC(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)CCC(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H20N2O6/c1-13(21-23-16-5-3-2-4-15(16)22(27)24-21)30-20(26)9-7-17(25)14-6-8-18-19(12-14)29-11-10-28-18/h2-6,8,12-13H,7,9-11H2,1H3,(H,23,24,27)