(1,4-dimethyl-1-octadecyl-pyrrolidin-1-ium-3-yl)methanesulfonic acid

Systemtic Name: (1,4-dimethyl-1-octadecyl-pyrrolidin-1-ium-3-yl)methanesulfonic acid Openeye Name: (1,4-dimethyl-1-octadecyl-pyrrolidin-1-ium-3-yl)methanesulfonic acid CAS Name: (1,4-dimethyl-1-octadecyl-3-pyrrolidin-1-iumyl)methanesulfonic acid IUPAC Name: (1,4-dimethyl-1-octadecylpyrrolidin-1-ium-3-yl)methanesulfonic acid Traditional Name: (1,4-dimethyl-1-stearyl-pyrrolidin-1-ium-3-yl)methanesulfonic acid Formula: C25H52NO3S+ MolecularWeight: 446.75028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+]1(CC(C(C1)CS(=O)(=O)O)C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+]1(CC(C(C1)CS(=O)(=O)O)C)C

InChI

InChI=1S/C25H51NO3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(3)21-24(2)25(22-26)23-30(27,28)29/h24-25H,4-23H2,1-3H3/p+1