2-(2-methylbut-3-en-2-yl)-2-phenyl-hexanenitrile

Systemtic Name: 2-(2-methylbut-3-en-2-yl)-2-phenyl-hexanenitrile Openeye Name: 2-(1,1-dimethylallyl)-2-phenyl-hexanenitrile CAS Name: 2-(2-methylbut-3-en-2-yl)-2-phenylhexanenitrile IUPAC Name: 2-(2-methylbut-3-en-2-yl)-2-phenylhexanenitrile Traditional Name: 2-butyl-3,3-dimethyl-2-phenyl-pent-4-enenitrile Formula: C17H23N MolecularWeight: 241.37122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N/c1-5-7-13-17(14-18,16(3,4)6-2)15-11-9-8-10-12-15/h6,8-12H,2,5,7,13H2,1,3-4H3