2-(2-azanylethylamino)ethylsulfanylphosphonic acid hydrate

Systemtic Name: 2-(2-azanylethylamino)ethylsulfanylphosphonic acid hydrate Openeye Name: 2-(2-aminoethylamino)ethylsulfanylphosphonic acid hydrate CAS Name: [2-(2-aminoethylamino)ethylthio]phosphonic acid hydrate IUPAC Name: 2-(2-aminoethylamino)ethylsulfanylphosphonic acid hydrate Traditional Name: [2-(2-aminoethylamino)ethylthio]phosphonic acid hydrate Formula: C4H15N2O4PS MolecularWeight: 218.211661

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Descriptors Computed from Structure

Canonical SMILES:

C(CNCCSP(=O)(O)O)N.O

Isomeric SMILES

C(CNCCSP(=O)(O)O)N.O

InChI

InChI=1S/C4H13N2O3PS.H2O/c5-1-2-6-3-4-11-10(7,8)9;/h6H,1-5H2,(H2,7,8,9);1H2