5-pentan-2-ylcyclohexa-1,5-diene-1-carbonitrile

Systemtic Name: 5-pentan-2-ylcyclohexa-1,5-diene-1-carbonitrile Openeye Name: 5-(1-methylbutyl)cyclohexa-1,5-diene-1-carbonitrile CAS Name: 5-pentan-2-yl-1-cyclohexa-1,5-dienecarbonitrile IUPAC Name: 5-pentan-2-ylcyclohexa-1,5-diene-1-carbonitrile Traditional Name: 5-(1-methylbutyl)cyclohexa-1,5-diene-1-carbonitrile Formula: C12H17N MolecularWeight: 175.27008

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=CC(=CCC1)C#N

Isomeric SMILES

CCCC(C)C1=CC(=CCC1)C#N

InChI

InChI=1S/C12H17N/c1-3-5-10(2)12-7-4-6-11(8-12)9-13/h6,8,10H,3-5,7H2,1-2H3