(5-phenyl-1,2-oxazol-3-yl)methyl 3-(4-cyanophenyl)propanoate

Systemtic Name: (5-phenyl-1,2-oxazol-3-yl)methyl 3-(4-cyanophenyl)propanoate Openeye Name: (5-phenylisoxazol-3-yl)methyl 3-(4-cyanophenyl)propanoate CAS Name: 3-(4-cyanophenyl)propanoic acid (5-phenyl-3-isoxazolyl)methyl ester IUPAC Name: (5-phenyl-1,2-oxazol-3-yl)methyl 3-(4-cyanophenyl)propanoate Traditional Name: 3-(4-cyanophenyl)propionic acid (5-phenylisoxazol-3-yl)methyl ester Formula: C20H16N2O3 MolecularWeight: 332.35264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NO2)COC(=O)CCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NO2)COC(=O)CCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H16N2O3/c21-13-16-8-6-15(7-9-16)10-11-20(23)24-14-18-12-19(25-22-18)17-4-2-1-3-5-17/h1-9,12H,10-11,14H2