2-[3-(4-methylphenyl)-1,2-oxazol-5-yl]ethanenitrile

Systemtic Name: 2-[3-(4-methylphenyl)-1,2-oxazol-5-yl]ethanenitrile Openeye Name: 2-[3-(p-tolyl)isoxazol-5-yl]acetonitrile CAS Name: 2-[3-(4-methylphenyl)-5-isoxazolyl]acetonitrile IUPAC Name: 2-[3-(4-methylphenyl)-1,2-oxazol-5-yl]acetonitrile Traditional Name: 2-[3-(p-tolyl)isoxazol-5-yl]acetonitrile Formula: C12H10N2O MolecularWeight: 198.2206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=C2)CC#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=C2)CC#N

InChI

InChI=1S/C12H10N2O/c1-9-2-4-10(5-3-9)12-8-11(6-7-13)15-14-12/h2-5,8H,6H2,1H3