(5-ethanoyl-2-methoxy-phenyl)methyl 3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)COC(=O)CCC2=NC3=CC=CC=C3C(=O)N2C

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)COC(=O)CCC2=NC3=CC=CC=C3C(=O)N2C

InChI

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