methyl 2-[3-(6-cyanopyridin-3-yl)-4,5-dihydro-1,2-oxazol-5-yl]ethanoate

Systemtic Name: methyl 2-[3-(6-cyanopyridin-3-yl)-4,5-dihydro-1,2-oxazol-5-yl]ethanoate Openeye Name: methyl 2-[3-(6-cyano-3-pyridyl)-4,5-dihydroisoxazol-5-yl]acetate CAS Name: 2-[3-(6-cyano-3-pyridinyl)-4,5-dihydroisoxazol-5-yl]acetic acid methyl ester IUPAC Name: methyl 2-[3-(6-cyanopyridin-3-yl)-4,5-dihydro-1,2-oxazol-5-yl]acetate Traditional Name: 2-[3-(6-cyano-3-pyridyl)-2-isoxazolin-5-yl]acetic acid methyl ester Formula: C12H11N3O3 MolecularWeight: 245.23404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11N3O3/c1-17-12(16)5-10-4-11(15-18-10)8-2-3-9(6-13)14-7-8/h2-3,7,10H,4-5H2,1H3