3-methyl-2-[3-(2,4,6-trimethylphenyl)-1,2,4-oxadiazol-5-yl]but-2-enenitrile

Systemtic Name: 3-methyl-2-[3-(2,4,6-trimethylphenyl)-1,2,4-oxadiazol-5-yl]but-2-enenitrile Openeye Name: 3-methyl-2-[3-(2,4,6-trimethylphenyl)-1,2,4-oxadiazol-5-yl]but-2-enenitrile CAS Name: 3-methyl-2-[3-(2,4,6-trimethylphenyl)-1,2,4-oxadiazol-5-yl]-2-butenenitrile IUPAC Name: 3-methyl-2-[3-(2,4,6-trimethylphenyl)-1,2,4-oxadiazol-5-yl]but-2-enenitrile Traditional Name: 2-(3-mesityl-1,2,4-oxadiazol-5-yl)-3-methyl-but-2-enenitrile Formula: C16H17N3O MolecularWeight: 267.32568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C2=NOC(=N2)C(=C(C)C)C#N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C2=NOC(=N2)C(=C(C)C)C#N)C

InChI

InChI=1S/C16H17N3O/c1-9(2)13(8-17)16-18-15(19-20-16)14-11(4)6-10(3)7-12(14)5/h6-7H,1-5H3