[2-(butylamino)-1-phosphono-ethyl]phosphonic acid

Systemtic Name: [2-(butylamino)-1-phosphono-ethyl]phosphonic acid Openeye Name: [2-(butylamino)-1-phosphono-ethyl]phosphonic acid CAS Name: [2-(butylamino)-1-phosphonoethyl]phosphonic acid IUPAC Name: [2-(butylamino)-1-phosphonoethyl]phosphonic acid Traditional Name: [2-(butylamino)-1-phosphono-ethyl]phosphonic acid Formula: C6H17NO6P2 MolecularWeight: 261.149802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCCCNCC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C6H17NO6P2/c1-2-3-4-7-5-6(14(8,9)10)15(11,12)13/h6-7H,2-5H2,1H3,(H2,8,9,10)(H2,11,12,13)