[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoate

Systemtic Name: [2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoate Openeye Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 3-(4-oxo-1H-quinazolin-2-yl)propanoate CAS Name: 3-(4-oxo-1H-quinazolin-2-yl)propanoic acid [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 3-(4-oxo-1H-quinazolin-2-yl)propanoate Traditional Name: 3-(4-keto-1H-quinazolin-2-yl)propionic acid [2-keto-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)COC(=O)CCC2=NC(=O)C3=CC=CC=C3N2)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)COC(=O)CCC2=NC(=O)C3=CC=CC=C3N2)C)C

InChI

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