5-[4-(phenylmethyl)piperidin-1-yl]pyridin-1-ium-2-amine

Systemtic Name: 5-[4-(phenylmethyl)piperidin-1-yl]pyridin-1-ium-2-amine Openeye Name: 5-(4-benzyl-1-piperidyl)pyridin-1-ium-2-amine CAS Name: 5-[4-(phenylmethyl)-1-piperidinyl]-2-pyridin-1-iumamine IUPAC Name: 5-(4-benzylpiperidin-1-yl)pyridin-1-ium-2-amine Traditional Name: [5-(4-benzylpiperidino)pyridin-1-ium-2-yl]amine Formula: C17H22N3+ MolecularWeight: 268.37668

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=C[NH+]=C(C=C3)N

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=C[NH+]=C(C=C3)N

InChI

InChI=1S/C17H21N3/c18-17-7-6-16(13-19-17)20-10-8-15(9-11-20)12-14-4-2-1-3-5-14/h1-7,13,15H,8-12H2,(H2,18,19)/p+1