4-(azocan-1-ium-1-ylmethyl)benzenecarbonitrile

Systemtic Name: 4-(azocan-1-ium-1-ylmethyl)benzenecarbonitrile Openeye Name: 4-(azocan-1-ium-1-ylmethyl)benzonitrile CAS Name: 4-(1-azocan-1-iumylmethyl)benzonitrile IUPAC Name: 4-(azocan-1-ium-1-ylmethyl)benzonitrile Traditional Name: 4-(azocan-1-ium-1-ylmethyl)benzonitrile Formula: C15H21N2+ MolecularWeight: 229.34064

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CCC1)CC2=CC=C(C=C2)C#N

Isomeric SMILES

C1CCC[NH+](CCC1)CC2=CC=C(C=C2)C#N

InChI

InChI=1S/C15H20N2/c16-12-14-6-8-15(9-7-14)13-17-10-4-2-1-3-5-11-17/h6-9H,1-5,10-11,13H2/p+1