1-ethyl-N-(3-methylsulfanylphenyl)piperidin-1-ium-4-amine

Systemtic Name: 1-ethyl-N-(3-methylsulfanylphenyl)piperidin-1-ium-4-amine Openeye Name: 1-ethyl-N-(3-methylsulfanylphenyl)piperidin-1-ium-4-amine CAS Name: 1-ethyl-N-[3-(methylthio)phenyl]-4-piperidin-1-iumamine IUPAC Name: 1-ethyl-N-(3-methylsulfanylphenyl)piperidin-1-ium-4-amine Traditional Name: (1-ethylpiperidin-1-ium-4-yl)-[3-(methylthio)phenyl]amine Formula: C14H23N2S+ MolecularWeight: 251.41082

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC2=CC(=CC=C2)SC

Isomeric SMILES

CC[NH+]1CCC(CC1)NC2=CC(=CC=C2)SC

InChI

InChI=1S/C14H22N2S/c1-3-16-9-7-12(8-10-16)15-13-5-4-6-14(11-13)17-2/h4-6,11-12,15H,3,7-10H2,1-2H3/p+1