(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-(4-ethylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: (8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-(4-ethylphenyl)-4-oxidanylidene-butanoate Openeye Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 4-(4-ethylphenyl)-4-oxo-butanoate CAS Name: 4-(4-ethylphenyl)-4-oxobutanoic acid (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 4-(4-ethylphenyl)-4-oxobutanoate Traditional Name: 4-(4-ethylphenyl)-4-keto-butyric acid (4-keto-8-methyl-1H-quinazolin-2-yl)methyl ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)CCC(=O)OCC2=NC(=O)C3=C(N2)C(=CC=C3)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)CCC(=O)OCC2=NC(=O)C3=C(N2)C(=CC=C3)C

InChI

InChI=1S/C22H22N2O4/c1-3-15-7-9-16(10-8-15)18(25)11-12-20(26)28-13-19-23-21-14(2)5-4-6-17(21)22(27)24-19/h4-10H,3,11-13H2,1-2H3,(H,23,24,27)