[(heptan-2-ylamino)-phosphono-methyl]phosphonic acid

Systemtic Name: [(heptan-2-ylamino)-phosphono-methyl]phosphonic acid Openeye Name: [(1-methylhexylamino)-phosphono-methyl]phosphonic acid CAS Name: [(heptan-2-ylamino)-phosphonomethyl]phosphonic acid IUPAC Name: [(heptan-2-ylamino)-phosphonomethyl]phosphonic acid Traditional Name: [(1-methylhexylamino)-phosphono-methyl]phosphonic acid Formula: C8H21NO6P2 MolecularWeight: 289.202962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCCCCC(C)NC(P(=O)(O)O)P(=O)(O)O

InChI

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