(4-chloranyl-3-ethyl-phenyl) 4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanoate

Systemtic Name: (4-chloranyl-3-ethyl-phenyl) 4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanoate Openeye Name: (4-chloro-3-ethyl-phenyl) 4-(8-methyl-4-oxo-quinazolin-3-yl)butanoate CAS Name: 4-(8-methyl-4-oxo-3-quinazolinyl)butanoic acid (4-chloro-3-ethylphenyl) ester IUPAC Name: (4-chloro-3-ethylphenyl) 4-(8-methyl-4-oxoquinazolin-3-yl)butanoate Traditional Name: 4-(4-keto-8-methyl-quinazolin-3-yl)butyric acid (4-chloro-3-ethyl-phenyl) ester Formula: C21H21ClN2O3 MolecularWeight: 384.85604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OC(=O)CCCN2C=NC3=C(C2=O)C=CC=C3C)Cl

Isomeric SMILES

CCC1=C(C=CC(=C1)OC(=O)CCCN2C=NC3=C(C2=O)C=CC=C3C)Cl

InChI

InChI=1S/C21H21ClN2O3/c1-3-15-12-16(9-10-18(15)22)27-19(25)8-5-11-24-13-23-20-14(2)6-4-7-17(20)21(24)26/h4,6-7,9-10,12-13H,3,5,8,11H2,1-2H3