cyclohexyl 2-(4-oxidanylidene-2-pyridin-3-yl-quinazolin-3-yl)butanoate

Systemtic Name: cyclohexyl 2-(4-oxidanylidene-2-pyridin-3-yl-quinazolin-3-yl)butanoate Openeye Name: cyclohexyl 2-[4-oxo-2-(3-pyridyl)quinazolin-3-yl]butanoate CAS Name: 2-[4-oxo-2-(3-pyridinyl)-3-quinazolinyl]butanoic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-(4-oxo-2-pyridin-3-ylquinazolin-3-yl)butanoate Traditional Name: 2-[4-keto-2-(3-pyridyl)quinazolin-3-yl]butyric acid cyclohexyl ester Formula: C23H25N3O3 MolecularWeight: 391.4629

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC1CCCCC1)N2C(=NC3=CC=CC=C3C2=O)C4=CN=CC=C4

Isomeric SMILES

CCC(C(=O)OC1CCCCC1)N2C(=NC3=CC=CC=C3C2=O)C4=CN=CC=C4

InChI

InChI=1S/C23H25N3O3/c1-2-20(23(28)29-17-10-4-3-5-11-17)26-21(16-9-8-14-24-15-16)25-19-13-7-6-12-18(19)22(26)27/h6-9,12-15,17,20H,2-5,10-11H2,1H3