(4-oxidanylidene-1H-quinazolin-2-yl)methyl 3-(3,4,5-trimethoxyphenyl)propanoate

Systemtic Name: (4-oxidanylidene-1H-quinazolin-2-yl)methyl 3-(3,4,5-trimethoxyphenyl)propanoate Openeye Name: (4-oxo-1H-quinazolin-2-yl)methyl 3-(3,4,5-trimethoxyphenyl)propanoate CAS Name: 3-(3,4,5-trimethoxyphenyl)propanoic acid (4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-quinazolin-2-yl)methyl 3-(3,4,5-trimethoxyphenyl)propanoate Traditional Name: 3-(3,4,5-trimethoxyphenyl)propionic acid (4-keto-1H-quinazolin-2-yl)methyl ester Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CCC(=O)OCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CCC(=O)OCC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C21H22N2O6/c1-26-16-10-13(11-17(27-2)20(16)28-3)8-9-19(24)29-12-18-22-15-7-5-4-6-14(15)21(25)23-18/h4-7,10-11H,8-9,12H2,1-3H3,(H,22,23,25)