[4-(3-acetyloxyhexadecoxy)-1-sulfonyl-heptyl]-trimethyl-azanium

Systemtic Name: [4-(3-acetyloxyhexadecoxy)-1-sulfonyl-heptyl]-trimethyl-azanium Openeye Name: [4-(3-acetoxyhexadecoxy)-1-sulfonyl-heptyl]-trimethyl-ammonium CAS Name: [4-(3-acetyloxyhexadecoxy)-1-sulfonylheptyl]-trimethylammonium IUPAC Name: [4-(3-acetyloxyhexadecoxy)-1-sulfonylheptyl]-trimethylazanium Traditional Name: [4-(3-acetoxyhexadecoxy)-1-sulfonyl-heptyl]-trimethyl-ammonium Formula: C28H56NO5S+ MolecularWeight: 518.81294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CCOC(CCC)CCC(=S(=O)=O)[N+](C)(C)C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCC(CCOC(CCC)CCC(=S(=O)=O)[N+](C)(C)C)OC(=O)C

InChI

InChI=1S/C28H56NO5S/c1-7-9-10-11-12-13-14-15-16-17-18-20-27(34-25(3)30)23-24-33-26(19-8-2)21-22-28(35(31)32)29(4,5)6/h26-27H,7-24H2,1-6H3/q+1