1-hexadecylsulfanyl-3-(1-methylpyrrolidin-1-ium-1-yl)propan-2-ol

Systemtic Name: 1-hexadecylsulfanyl-3-(1-methylpyrrolidin-1-ium-1-yl)propan-2-ol Openeye Name: 1-hexadecylsulfanyl-3-(1-methylpyrrolidin-1-ium-1-yl)propan-2-ol CAS Name: 1-(hexadecylthio)-3-(1-methyl-1-pyrrolidin-1-iumyl)-2-propanol IUPAC Name: 1-hexadecylsulfanyl-3-(1-methylpyrrolidin-1-ium-1-yl)propan-2-ol Traditional Name: 1-(cetylthio)-3-(1-methylpyrrolidin-1-ium-1-yl)propan-2-ol Formula: C24H50NOS+ MolecularWeight: 400.7249

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSCC(C[N+]1(CCCC1)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCCSCC(C[N+]1(CCCC1)C)O

InChI

InChI=1S/C24H50NOS/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-27-23-24(26)22-25(2)19-16-17-20-25/h24,26H,3-23H2,1-2H3/q+1