methyl 3-(2-chlorophenyl)-3-[3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propanoylamino]propanoate

Systemtic Name: methyl 3-(2-chlorophenyl)-3-[3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propanoylamino]propanoate Openeye Name: methyl 3-(2-chlorophenyl)-3-[3-(2-methyl-4-oxo-quinazolin-3-yl)propanoylamino]propanoate CAS Name: 3-(2-chlorophenyl)-3-[[3-(2-methyl-4-oxo-3-quinazolinyl)-1-oxopropyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(2-chlorophenyl)-3-[3-(2-methyl-4-oxoquinazolin-3-yl)propanoylamino]propanoate Traditional Name: 3-(2-chlorophenyl)-3-[3-(4-keto-2-methyl-quinazolin-3-yl)propanoylamino]propionic acid methyl ester Formula: C22H22ClN3O4 MolecularWeight: 427.88078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CCC(=O)NC(CC(=O)OC)C3=CC=CC=C3Cl

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CCC(=O)NC(CC(=O)OC)C3=CC=CC=C3Cl

InChI

InChI=1S/C22H22ClN3O4/c1-14-24-18-10-6-4-8-16(18)22(29)26(14)12-11-20(27)25-19(13-21(28)30-2)15-7-3-5-9-17(15)23/h3-10,19H,11-13H2,1-2H3,(H,25,27)