N-(2-methylsulfanylphenyl)-1-propyl-piperidin-1-ium-4-amine

Systemtic Name: N-(2-methylsulfanylphenyl)-1-propyl-piperidin-1-ium-4-amine Openeye Name: N-(2-methylsulfanylphenyl)-1-propyl-piperidin-1-ium-4-amine CAS Name: N-[2-(methylthio)phenyl]-1-propyl-4-piperidin-1-iumamine IUPAC Name: N-(2-methylsulfanylphenyl)-1-propylpiperidin-1-ium-4-amine Traditional Name: [2-(methylthio)phenyl]-(1-propylpiperidin-1-ium-4-yl)amine Formula: C15H25N2S+ MolecularWeight: 265.4374

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC2=CC=CC=C2SC

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC2=CC=CC=C2SC

InChI

InChI=1S/C15H24N2S/c1-3-10-17-11-8-13(9-12-17)16-14-6-4-5-7-15(14)18-2/h4-7,13,16H,3,8-12H2,1-2H3/p+1