methyl 5-(phenylcarbonyl)-3-(4-propan-2-ylphenyl)-4H-1,2-oxazole-5-carboxylate

Systemtic Name: methyl 5-(phenylcarbonyl)-3-(4-propan-2-ylphenyl)-4H-1,2-oxazole-5-carboxylate Openeye Name: methyl 5-benzoyl-3-(4-isopropylphenyl)-4H-isoxazole-5-carboxylate CAS Name: 5-benzoyl-3-(4-propan-2-ylphenyl)-4H-isoxazole-5-carboxylic acid methyl ester IUPAC Name: methyl 5-benzoyl-3-(4-propan-2-ylphenyl)-4H-1,2-oxazole-5-carboxylate Traditional Name: 5-benzoyl-3-p-cumenyl-2-isoxazoline-5-carboxylic acid methyl ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NOC(C2)(C(=O)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NOC(C2)(C(=O)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C21H21NO4/c1-14(2)15-9-11-16(12-10-15)18-13-21(26-22-18,20(24)25-3)19(23)17-7-5-4-6-8-17/h4-12,14H,13H2,1-3H3