2-(6-azanylhexylamino)ethylsulfanylphosphonic acid hydrate

Systemtic Name: 2-(6-azanylhexylamino)ethylsulfanylphosphonic acid hydrate Openeye Name: 2-(6-aminohexylamino)ethylsulfanylphosphonic acid hydrate CAS Name: [2-(6-aminohexylamino)ethylthio]phosphonic acid hydrate IUPAC Name: 2-(6-aminohexylamino)ethylsulfanylphosphonic acid hydrate Traditional Name: [2-(6-aminohexylamino)ethylthio]phosphonic acid hydrate Formula: C8H23N2O4PS MolecularWeight: 274.317981

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCNCCSP(=O)(O)O)CCN.O

Isomeric SMILES

C(CCCNCCSP(=O)(O)O)CCN.O

InChI

InChI=1S/C8H21N2O3PS.H2O/c9-5-3-1-2-4-6-10-7-8-15-14(11,12)13;/h10H,1-9H2,(H2,11,12,13);1H2