2-acetamidoethoxy-oxidanidyl-oxidanylidene-phosphanium; [2-acetamidoethylsulfanyl(azanyl)methylidene]azanium; hydrate

Systemtic Name: 2-acetamidoethoxy-oxidanidyl-oxidanylidene-phosphanium; [2-acetamidoethylsulfanyl(azanyl)methylidene]azanium; hydrate Openeye Name: 2-acetamidoethoxy-oxido-oxo-phosphonium; [2-acetamidoethylsulfanyl(amino)methylene]ammonium; hydrate CAS Name: 2-acetamidoethoxy-oxido-oxophosphonium; [(2-acetamidoethylthio)-aminomethylidene]ammonium; hydrate IUPAC Name: 2-acetamidoethoxy-oxido-oxophosphanium; [2-acetamidoethylsulfanyl(amino)methylidene]azanium; hydrate Traditional Name: 2-acetamidoethoxy-keto-oxido-phosphonium; [(2-acetamidoethylthio)-amino-methylene]ammonium; hydrate Formula: C9H22N4O6PS+ MolecularWeight: 345.332941

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCO[P+](=O)[O-].CC(=O)NCCSC(=[NH2+])N.O

Isomeric SMILES

CC(=O)NCCO[P+](=O)[O-].CC(=O)NCCSC(=[NH2+])N.O

InChI

InChI=1S/C5H11N3OS.C4H8NO4P.H2O/c1-4(9)8-2-3-10-5(6)7;1-4(6)5-2-3-9-10(7)8;/h2-3H2,1H3,(H3,6,7)(H,8,9);2-3H2,1H3,(H,5,6);1H2/p+1