1-azanylpropylphosphonic acid; 2-[2-(phosphonoamino)ethanoylamino]ethanoic acid; dihydrate

Systemtic Name: 1-azanylpropylphosphonic acid; 2-[2-(phosphonoamino)ethanoylamino]ethanoic acid; dihydrate Openeye Name: 1-aminopropylphosphonic acid; 2-[[2-(phosphonoamino)acetyl]amino]acetic acid; dihydrate CAS Name: 1-aminopropylphosphonic acid; 2-[[1-oxo-2-(phosphonoamino)ethyl]amino]acetic acid; dihydrate IUPAC Name: 1-aminopropylphosphonic acid; 2-[[2-(phosphonoamino)acetyl]amino]acetic acid; dihydrate Traditional Name: 1-aminopropylphosphonic acid; 2-[[2-(phosphonoamino)acetyl]amino]acetic acid; dihydrate Formula: C7H23N3O11P2 MolecularWeight: 387.218542

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N)P(=O)(O)O.C(C(=O)NCC(=O)O)NP(=O)(O)O.O.O

Isomeric SMILES

CCC(N)P(=O)(O)O.C(C(=O)NCC(=O)O)NP(=O)(O)O.O.O

InChI

InChI=1S/C4H9N2O6P.C3H10NO3P.2H2O/c7-3(5-2-4(8)9)1-6-13(10,11)12;1-2-3(4)8(5,6)7;;/h1-2H2,(H,5,7)(H,8,9)(H3,6,10,11,12);3H,2,4H2,1H3,(H2,5,6,7);2*1H2