4-methyl-1-[2-(2-phenylsulfanylethoxy)ethyl]piperidin-1-ium

Systemtic Name: 4-methyl-1-[2-(2-phenylsulfanylethoxy)ethyl]piperidin-1-ium Openeye Name: 4-methyl-1-[2-(2-phenylsulfanylethoxy)ethyl]piperidin-1-ium CAS Name: 4-methyl-1-[2-[2-(phenylthio)ethoxy]ethyl]piperidin-1-ium IUPAC Name: 4-methyl-1-[2-(2-phenylsulfanylethoxy)ethyl]piperidin-1-ium Traditional Name: 4-methyl-1-[2-[2-(phenylthio)ethoxy]ethyl]piperidin-1-ium Formula: C16H26NOS+ MolecularWeight: 280.44874

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCOCCSC2=CC=CC=C2

Isomeric SMILES

CC1CC[NH+](CC1)CCOCCSC2=CC=CC=C2

InChI

InChI=1S/C16H25NOS/c1-15-7-9-17(10-8-15)11-12-18-13-14-19-16-5-3-2-4-6-16/h2-6,15H,7-14H2,1H3/p+1