[(3R)-3,5-bis(oxidanyl)-5-oxidanylidene-4-(propanoylsulfanylmethyl)pentyl]-trimethyl-azanium

Systemtic Name: [(3R)-3,5-bis(oxidanyl)-5-oxidanylidene-4-(propanoylsulfanylmethyl)pentyl]-trimethyl-azanium Openeye Name: [(3R)-3,5-dihydroxy-5-oxo-4-(propanoylsulfanylmethyl)pentyl]-trimethyl-ammonium CAS Name: [(3R)-3,5-dihydroxy-5-oxo-4-[(1-oxopropylthio)methyl]pentyl]-trimethylammonium IUPAC Name: [(3R)-3,5-dihydroxy-5-oxo-4-(propanoylsulfanylmethyl)pentyl]-trimethylazanium Traditional Name: [(3R)-3,5-dihydroxy-5-keto-4-[(propionylthio)methyl]pentyl]-trimethyl-ammonium Formula: C12H24NO4S+ MolecularWeight: 278.38826

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)SCC(C(CC[N+](C)(C)C)O)C(=O)O

Isomeric SMILES

CCC(=O)SCC([C@@H](CC[N+](C)(C)C)O)C(=O)O

InChI

InChI=1S/C12H23NO4S/c1-5-11(15)18-8-9(12(16)17)10(14)6-7-13(2,3)4/h9-10,14H,5-8H2,1-4H3/p+1/t9?,10-/m1/s1