3-piperidin-1-ium-4-ylbenzenecarbonitrile

Systemtic Name: 3-piperidin-1-ium-4-ylbenzenecarbonitrile Openeye Name: 3-piperidin-1-ium-4-ylbenzonitrile CAS Name: 3-(4-piperidin-1-iumyl)benzonitrile IUPAC Name: 3-piperidin-1-ium-4-ylbenzonitrile Traditional Name: 3-piperidin-1-ium-4-ylbenzonitrile Formula: C12H15N2+ MolecularWeight: 187.2609

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1C2=CC=CC(=C2)C#N

Isomeric SMILES

C1C[NH2+]CCC1C2=CC=CC(=C2)C#N

InChI

InChI=1S/C12H14N2/c13-9-10-2-1-3-12(8-10)11-4-6-14-7-5-11/h1-3,8,11,14H,4-7H2/p+1