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

Systemtic Name: (4-cyanophenyl) 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate Openeye Name: (4-cyanophenyl) 3-ethyl-5-methyl-isoxazole-4-carboxylate CAS Name: 3-ethyl-5-methyl-4-isoxazolecarboxylic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate Traditional Name: 3-ethyl-5-methyl-isoxazole-4-carboxylic acid (4-cyanophenyl) ester Formula: C14H12N2O3 MolecularWeight: 256.25668

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)OC2=CC=C(C=C2)C#N)C

Isomeric SMILES

CCC1=NOC(=C1C(=O)OC2=CC=C(C=C2)C#N)C

InChI

InChI=1S/C14H12N2O3/c1-3-12-13(9(2)19-16-12)14(17)18-11-6-4-10(8-15)5-7-11/h4-7H,3H2,1-2H3