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

Systemtic Name: (2-chloranyl-4-cyano-phenyl) 4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanoate Openeye Name: (2-chloro-4-cyano-phenyl) 4-(8-methyl-4-oxo-quinazolin-3-yl)butanoate CAS Name: 4-(8-methyl-4-oxo-3-quinazolinyl)butanoic acid (2-chloro-4-cyanophenyl) ester IUPAC Name: (2-chloro-4-cyanophenyl) 4-(8-methyl-4-oxoquinazolin-3-yl)butanoate Traditional Name: 4-(4-keto-8-methyl-quinazolin-3-yl)butyric acid (2-chloro-4-cyano-phenyl) ester Formula: C20H16ClN3O3 MolecularWeight: 381.81234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CCCC(=O)OC3=C(C=C(C=C3)C#N)Cl

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CCCC(=O)OC3=C(C=C(C=C3)C#N)Cl

InChI

InChI=1S/C20H16ClN3O3/c1-13-4-2-5-15-19(13)23-12-24(20(15)26)9-3-6-18(25)27-17-8-7-14(11-22)10-16(17)21/h2,4-5,7-8,10,12H,3,6,9H2,1H3