N-(5-chloranyl-2-methoxy-phenyl)-4-(6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)butanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-4-(6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)butanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-4-(6,7-dimethoxy-4-oxo-quinazolin-3-yl)butanamide CAS Name: N-(5-chloro-2-methoxyphenyl)-4-(6,7-dimethoxy-4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-4-(6,7-dimethoxy-4-oxoquinazolin-3-yl)butanamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-4-(4-keto-6,7-dimethoxy-quinazolin-3-yl)butyramide Formula: C21H22ClN3O5 MolecularWeight: 431.86948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CCCN2C=NC3=CC(=C(C=C3C2=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CCCN2C=NC3=CC(=C(C=C3C2=O)OC)OC

InChI

InChI=1S/C21H22ClN3O5/c1-28-17-7-6-13(22)9-16(17)24-20(26)5-4-8-25-12-23-15-11-19(30-3)18(29-2)10-14(15)21(25)27/h6-7,9-12H,4-5,8H2,1-3H3,(H,24,26)