(2,4-dimethylphenyl) 4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanoate

Systemtic Name: (2,4-dimethylphenyl) 4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanoate Openeye Name: (2,4-dimethylphenyl) 4-(8-methyl-4-oxo-quinazolin-3-yl)butanoate CAS Name: 4-(8-methyl-4-oxo-3-quinazolinyl)butanoic acid (2,4-dimethylphenyl) ester IUPAC Name: (2,4-dimethylphenyl) 4-(8-methyl-4-oxoquinazolin-3-yl)butanoate Traditional Name: 4-(4-keto-8-methyl-quinazolin-3-yl)butyric acid (2,4-dimethylphenyl) ester Formula: C21H22N2O3 MolecularWeight: 350.41098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)CCCN2C=NC3=C(C2=O)C=CC=C3C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)CCCN2C=NC3=C(C2=O)C=CC=C3C)C

InChI

InChI=1S/C21H22N2O3/c1-14-9-10-18(16(3)12-14)26-19(24)8-5-11-23-13-22-20-15(2)6-4-7-17(20)21(23)25/h4,6-7,9-10,12-13H,5,8,11H2,1-3H3