(3-azanyl-1-phosphono-octyl)phosphonic acid

Systemtic Name: (3-azanyl-1-phosphono-octyl)phosphonic acid Openeye Name: (3-amino-1-phosphono-octyl)phosphonic acid CAS Name: (3-amino-1-phosphonooctyl)phosphonic acid IUPAC Name: (3-amino-1-phosphonooctyl)phosphonic acid Traditional Name: (3-amino-1-phosphono-octyl)phosphonic acid Formula: C8H21NO6P2 MolecularWeight: 289.202962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(P(=O)(O)O)P(=O)(O)O)N

Isomeric SMILES

CCCCCC(CC(P(=O)(O)O)P(=O)(O)O)N

InChI

InChI=1S/C8H21NO6P2/c1-2-3-4-5-7(9)6-8(16(10,11)12)17(13,14)15/h7-8H,2-6,9H2,1H3,(H2,10,11,12)(H2,13,14,15)