(2,3,6-trimethylphenyl) 4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanoate

Systemtic Name: (2,3,6-trimethylphenyl) 4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanoate Openeye Name: (2,3,6-trimethylphenyl) 4-(8-methyl-4-oxo-quinazolin-3-yl)butanoate CAS Name: 4-(8-methyl-4-oxo-3-quinazolinyl)butanoic acid (2,3,6-trimethylphenyl) ester IUPAC Name: (2,3,6-trimethylphenyl) 4-(8-methyl-4-oxoquinazolin-3-yl)butanoate Traditional Name: 4-(4-keto-8-methyl-quinazolin-3-yl)butyric acid (2,3,6-trimethylphenyl) ester Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O3/c1-14-10-11-16(3)21(17(14)4)27-19(25)9-6-12-24-13-23-20-15(2)7-5-8-18(20)22(24)26/h5,7-8,10-11,13H,6,9,12H2,1-4H3