4-[6-(4-chlorophenyl)-4-methyl-5-morpholin-4-ylcarbonyl-2-oxidanylidene-1,6-dihydropyrimidin-3-yl]benzoic acid

Systemtic Name: 4-[6-(4-chlorophenyl)-4-methyl-5-morpholin-4-ylcarbonyl-2-oxidanylidene-1,6-dihydropyrimidin-3-yl]benzoic acid Openeye Name: 4-[6-(4-chlorophenyl)-4-methyl-5-(morpholine-4-carbonyl)-2-oxo-1,6-dihydropyrimidin-3-yl]benzoic acid CAS Name: 4-[6-(4-chlorophenyl)-4-methyl-5-[4-morpholinyl(oxo)methyl]-2-oxo-1,6-dihydropyrimidin-3-yl]benzoic acid IUPAC Name: 4-[6-(4-chlorophenyl)-4-methyl-5-(morpholine-4-carbonyl)-2-oxo-1,6-dihydropyrimidin-3-yl]benzoic acid Traditional Name: 4-[6-(4-chlorophenyl)-2-keto-4-methyl-5-(morpholine-4-carbonyl)-1,6-dihydropyrimidin-3-yl]benzoic acid Formula: C23H22ClN3O5 MolecularWeight: 455.89088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1C2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)Cl)C(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C(NC(=O)N1C2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)Cl)C(=O)N4CCOCC4

InChI

InChI=1S/C23H22ClN3O5/c1-14-19(21(28)26-10-12-32-13-11-26)20(15-2-6-17(24)7-3-15)25-23(31)27(14)18-8-4-16(5-9-18)22(29)30/h2-9,20H,10-13H2,1H3,(H,25,31)(H,29,30)