1-[1-(2-methylbutan-2-yl)pyrrol-1-ium-1-yl]cyclohexane-1-carbonitrile

Systemtic Name: 1-[1-(2-methylbutan-2-yl)pyrrol-1-ium-1-yl]cyclohexane-1-carbonitrile Openeye Name: 1-[1-(1,1-dimethylpropyl)pyrrol-1-ium-1-yl]cyclohexanecarbonitrile CAS Name: 1-[1-(2-methylbutan-2-yl)-1-pyrrol-1-iumyl]-1-cyclohexanecarbonitrile IUPAC Name: 1-[1-(2-methylbutan-2-yl)pyrrol-1-ium-1-yl]cyclohexane-1-carbonitrile Traditional Name: 1-(1-tert-amylpyrrol-1-ium-1-yl)cyclohexanecarbonitrile Formula: C16H25N2+ MolecularWeight: 245.3831

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)[N+]1(C=CC=C1)C2(CCCCC2)C#N

Isomeric SMILES

CCC(C)(C)[N+]1(C=CC=C1)C2(CCCCC2)C#N

InChI

InChI=1S/C16H25N2/c1-4-15(2,3)18(12-8-9-13-18)16(14-17)10-6-5-7-11-16/h8-9,12-13H,4-7,10-11H2,1-3H3/q+1