[1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 3-(4-oxidanylidenequinazolin-3-yl)propanoate

Systemtic Name: [1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 3-(4-oxidanylidenequinazolin-3-yl)propanoate Openeye Name: [2-(4-ethylphenyl)-1-methyl-2-oxo-ethyl] 3-(4-oxoquinazolin-3-yl)propanoate CAS Name: 3-(4-oxo-3-quinazolinyl)propanoic acid [1-(4-ethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-ethylphenyl)-1-oxopropan-2-yl] 3-(4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-(4-ketoquinazolin-3-yl)propionic acid [2-(4-ethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)CCN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)CCN2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C22H22N2O4/c1-3-16-8-10-17(11-9-16)21(26)15(2)28-20(25)12-13-24-14-23-19-7-5-4-6-18(19)22(24)27/h4-11,14-15H,3,12-13H2,1-2H3