2-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]ethanenitrile

Systemtic Name: 2-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]ethanenitrile Openeye Name: 2-[3-(4-isopropylphenyl)-1,2,4-oxadiazol-5-yl]acetonitrile CAS Name: 2-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]acetonitrile IUPAC Name: 2-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]acetonitrile Traditional Name: 2-(3-p-cumenyl-1,2,4-oxadiazol-5-yl)acetonitrile Formula: C13H13N3O MolecularWeight: 227.26182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)CC#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)CC#N

InChI

InChI=1S/C13H13N3O/c1-9(2)10-3-5-11(6-4-10)13-15-12(7-8-14)17-16-13/h3-6,9H,7H2,1-2H3