[[dimethyl-(phenylmethyl)azaniumyl]-phosphono-methyl]-oxidanyl-phosphinate hydrate

Systemtic Name: [[dimethyl-(phenylmethyl)azaniumyl]-phosphono-methyl]-oxidanyl-phosphinate hydrate Openeye Name: [[benzyl(dimethyl)ammonio]-phosphono-methyl]-hydroxy-phosphinate hydrate CAS Name: [[dimethyl-(phenylmethyl)ammonio]-phosphonomethyl]-hydroxyphosphinate hydrate IUPAC Name: [[benzyl(dimethyl)azaniumyl]-phosphonomethyl]-hydroxyphosphinate hydrate Traditional Name: [[benzyl(dimethyl)ammonio]-phosphono-methyl]-hydroxy-phosphinate hydrate Formula: C10H19NO7P2 MolecularWeight: 327.207882

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC1=CC=CC=C1)C(P(=O)(O)O)P(=O)(O)[O-].O

Isomeric SMILES

C[N+](C)(CC1=CC=CC=C1)C(P(=O)(O)O)P(=O)(O)[O-].O

InChI

InChI=1S/C10H17NO6P2.H2O/c1-11(2,8-9-6-4-3-5-7-9)10(18(12,13)14)19(15,16)17;/h3-7,10H,8H2,1-2H3,(H3-,12,13,14,15,16,17);1H2