4-(2-methylbut-3-yn-2-yl)benzenecarbonitrile

Systemtic Name: 4-(2-methylbut-3-yn-2-yl)benzenecarbonitrile Openeye Name: 4-(1,1-dimethylprop-2-ynyl)benzonitrile CAS Name: 4-(2-methylbut-3-yn-2-yl)benzonitrile IUPAC Name: 4-(2-methylbut-3-yn-2-yl)benzonitrile Traditional Name: 4-(1,1-dimethylprop-2-ynyl)benzonitrile Formula: C12H11N MolecularWeight: 169.22244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#C)C1=CC=C(C=C1)C#N

Isomeric SMILES

CC(C)(C#C)C1=CC=C(C=C1)C#N

InChI

InChI=1S/C12H11N/c1-4-12(2,3)11-7-5-10(9-13)6-8-11/h1,5-8H,2-3H3