(6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 3-(ethoxymethyl)-4-methoxy-benzoate

Systemtic Name: (6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 3-(ethoxymethyl)-4-methoxy-benzoate Openeye Name: (6-chloro-4-oxo-1H-quinazolin-2-yl)methyl 3-(ethoxymethyl)-4-methoxy-benzoate CAS Name: 3-(ethoxymethyl)-4-methoxybenzoic acid (6-chloro-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (6-chloro-4-oxo-1H-quinazolin-2-yl)methyl 3-(ethoxymethyl)-4-methoxybenzoate Traditional Name: 3-(ethoxymethyl)-4-methoxy-benzoic acid (6-chloro-4-keto-1H-quinazolin-2-yl)methyl ester Formula: C20H19ClN2O5 MolecularWeight: 402.82826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=C(C=CC(=C1)C(=O)OCC2=NC(=O)C3=C(N2)C=CC(=C3)Cl)OC

Isomeric SMILES

CCOCC1=C(C=CC(=C1)C(=O)OCC2=NC(=O)C3=C(N2)C=CC(=C3)Cl)OC

InChI

InChI=1S/C20H19ClN2O5/c1-3-27-10-13-8-12(4-7-17(13)26-2)20(25)28-11-18-22-16-6-5-14(21)9-15(16)19(24)23-18/h4-9H,3,10-11H2,1-2H3,(H,22,23,24)