(5-methyl-1,2-oxazol-3-yl)methyl 3-cyanobenzoate

Systemtic Name: (5-methyl-1,2-oxazol-3-yl)methyl 3-cyanobenzoate Openeye Name: (5-methylisoxazol-3-yl)methyl 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid (5-methyl-3-isoxazolyl)methyl ester IUPAC Name: (5-methyl-1,2-oxazol-3-yl)methyl 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid (5-methylisoxazol-3-yl)methyl ester Formula: C13H10N2O3 MolecularWeight: 242.2301

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)COC(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CC1=CC(=NO1)COC(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C13H10N2O3/c1-9-5-12(15-18-9)8-17-13(16)11-4-2-3-10(6-11)7-14/h2-6H,8H2,1H3