(4-butanoylphenyl) 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate

Systemtic Name: (4-butanoylphenyl) 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate Openeye Name: (4-butanoylphenyl) 3-(2-chlorophenyl)-5-methyl-isoxazole-4-carboxylate CAS Name: 3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxylic acid [4-(1-oxobutyl)phenyl] ester IUPAC Name: (4-butanoylphenyl) 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate Traditional Name: 3-(2-chlorophenyl)-5-methyl-isoxazole-4-carboxylic acid (4-butyrylphenyl) ester Formula: C21H18ClNO4 MolecularWeight: 383.82492

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC=C(C=C1)OC(=O)C2=C(ON=C2C3=CC=CC=C3Cl)C

Isomeric SMILES

CCCC(=O)C1=CC=C(C=C1)OC(=O)C2=C(ON=C2C3=CC=CC=C3Cl)C

InChI

InChI=1S/C21H18ClNO4/c1-3-6-18(24)14-9-11-15(12-10-14)26-21(25)19-13(2)27-23-20(19)16-7-4-5-8-17(16)22/h4-5,7-12H,3,6H2,1-2H3