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

Systemtic Name: [2-(hexylamino)-1-phosphono-ethyl]phosphonic acid Openeye Name: [2-(hexylamino)-1-phosphono-ethyl]phosphonic acid CAS Name: [2-(hexylamino)-1-phosphonoethyl]phosphonic acid IUPAC Name: [2-(hexylamino)-1-phosphonoethyl]phosphonic acid Traditional Name: [2-(hexylamino)-1-phosphono-ethyl]phosphonic acid Formula: C8H21NO6P2 MolecularWeight: 289.202962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNCC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCCCCCNCC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C8H21NO6P2/c1-2-3-4-5-6-9-7-8(16(10,11)12)17(13,14)15/h8-9H,2-7H2,1H3,(H2,10,11,12)(H2,13,14,15)