(5-ethanoyl-2-ethoxy-phenyl)methyl 3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoate

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl 3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoate Openeye Name: (5-acetyl-2-ethoxy-phenyl)methyl 3-(4-oxo-1H-quinazolin-2-yl)propanoate CAS Name: 3-(4-oxo-1H-quinazolin-2-yl)propanoic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl 3-(4-oxo-1H-quinazolin-2-yl)propanoate Traditional Name: 3-(4-keto-1H-quinazolin-2-yl)propionic acid (5-acetyl-2-ethoxy-benzyl) ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)CCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)CCC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C22H22N2O5/c1-3-28-19-9-8-15(14(2)25)12-16(19)13-29-21(26)11-10-20-23-18-7-5-4-6-17(18)22(27)24-20/h4-9,12H,3,10-11,13H2,1-2H3,(H,23,24,27)