1-(dodecylsulfanylmethyl)-N,N-dimethyl-pyridin-1-ium-4-amine

Systemtic Name: 1-(dodecylsulfanylmethyl)-N,N-dimethyl-pyridin-1-ium-4-amine Openeye Name: 1-(dodecylsulfanylmethyl)-N,N-dimethyl-pyridin-1-ium-4-amine CAS Name: 1-[(dodecylthio)methyl]-N,N-dimethyl-4-pyridin-1-iumamine IUPAC Name: 1-(dodecylsulfanylmethyl)-N,N-dimethylpyridin-1-ium-4-amine Traditional Name: [1-[(laurylthio)methyl]pyridin-1-ium-4-yl]-dimethyl-amine Formula: C20H37N2S+ MolecularWeight: 337.58618

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC[N+]1=CC=C(C=C1)N(C)C

Isomeric SMILES

CCCCCCCCCCCCSC[N+]1=CC=C(C=C1)N(C)C

InChI

InChI=1S/C20H37N2S/c1-4-5-6-7-8-9-10-11-12-13-18-23-19-22-16-14-20(15-17-22)21(2)3/h14-17H,4-13,18-19H2,1-3H3/q+1