ethyl-dimethyl-[2-(phosphonatocarbothioylamino)ethyl]azanium; 2-(trimethylazaniumyl)ethanoate

Systemtic Name: ethyl-dimethyl-[2-(phosphonatocarbothioylamino)ethyl]azanium; 2-(trimethylazaniumyl)ethanoate Openeye Name: ethyl-dimethyl-[2-(phosphonatocarbothioylamino)ethyl]ammonium; 2-(trimethylammonio)acetate CAS Name: ethyl-dimethyl-[2-[[phosphonato(sulfanylidene)methyl]amino]ethyl]ammonium; 2-(trimethylammonio)acetate IUPAC Name: ethyl-dimethyl-[2-(phosphonatocarbothioylamino)ethyl]azanium; 2-(trimethylazaniumyl)acetate Traditional Name: ethyl-dimethyl-[2-(phosphonatocarbothioylamino)ethyl]ammonium; 2-(trimethylammonio)acetate Formula: C12H27N3O5PS- MolecularWeight: 356.398641

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(C)CCNC(=S)P(=O)([O-])[O-].C[N+](C)(C)CC(=O)[O-]

Isomeric SMILES

CC[N+](C)(C)CCNC(=S)P(=O)([O-])[O-].C[N+](C)(C)CC(=O)[O-]

InChI

InChI=1S/C7H17N2O3PS.C5H11NO2/c1-4-9(2,3)6-5-8-7(14)13(10,11)12;1-6(2,3)4-5(7)8/h4-6H2,1-3H3,(H2-,8,10,11,12,14);4H2,1-3H3/p-1