methyl 2-[3-(4-cyanophenyl)-4,5-dihydro-1,2-oxazol-5-yl]ethanoate

Systemtic Name: methyl 2-[3-(4-cyanophenyl)-4,5-dihydro-1,2-oxazol-5-yl]ethanoate Openeye Name: methyl 2-[3-(4-cyanophenyl)-4,5-dihydroisoxazol-5-yl]acetate CAS Name: 2-[3-(4-cyanophenyl)-4,5-dihydroisoxazol-5-yl]acetic acid methyl ester IUPAC Name: methyl 2-[3-(4-cyanophenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetate Traditional Name: 2-[3-(4-cyanophenyl)-2-isoxazolin-5-yl]acetic acid methyl ester Formula: C13H12N2O3 MolecularWeight: 244.24598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CC(=NO1)C2=CC=C(C=C2)C#N

Isomeric SMILES

COC(=O)CC1CC(=NO1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C13H12N2O3/c1-17-13(16)7-11-6-12(15-18-11)10-4-2-9(8-14)3-5-10/h2-5,11H,6-7H2,1H3