1-[(4-tert-butylphenyl)methyl]pyridin-1-ium-4-carbonitrile

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]pyridin-1-ium-4-carbonitrile Openeye Name: 1-[(4-tert-butylphenyl)methyl]pyridin-1-ium-4-carbonitrile CAS Name: 1-[(4-tert-butylphenyl)methyl]-4-pyridin-1-iumcarbonitrile IUPAC Name: 1-[(4-tert-butylphenyl)methyl]pyridin-1-ium-4-carbonitrile Traditional Name: 1-(4-tert-butylbenzyl)pyridin-1-ium-4-carbonitrile Formula: C17H19N2+ MolecularWeight: 251.34616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C[N+]2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C[N+]2=CC=C(C=C2)C#N

InChI

InChI=1S/C17H19N2/c1-17(2,3)16-6-4-15(5-7-16)13-19-10-8-14(12-18)9-11-19/h4-11H,13H2,1-3H3/q+1