[4-(2-cyanophenyl)phenyl]methyl 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate

Systemtic Name: [4-(2-cyanophenyl)phenyl]methyl 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate Openeye Name: [4-(2-cyanophenyl)phenyl]methyl 3-ethyl-5-methyl-isoxazole-4-carboxylate CAS Name: 3-ethyl-5-methyl-4-isoxazolecarboxylic acid [4-(2-cyanophenyl)phenyl]methyl ester IUPAC Name: [4-(2-cyanophenyl)phenyl]methyl 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate Traditional Name: 3-ethyl-5-methyl-isoxazole-4-carboxylic acid [4-(2-cyanophenyl)benzyl] ester Formula: C21H18N2O3 MolecularWeight: 346.37922

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3C#N)C

Isomeric SMILES

CCC1=NOC(=C1C(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3C#N)C

InChI

InChI=1S/C21H18N2O3/c1-3-19-20(14(2)26-23-19)21(24)25-13-15-8-10-16(11-9-15)18-7-5-4-6-17(18)12-22/h4-11H,3,13H2,1-2H3