[phosphonomethyl(3,5,5-trimethylhexyl)amino]methylphosphonic acid

Systemtic Name: [phosphonomethyl(3,5,5-trimethylhexyl)amino]methylphosphonic acid Openeye Name: [phosphonomethyl(3,5,5-trimethylhexyl)amino]methylphosphonic acid CAS Name: [phosphonomethyl(3,5,5-trimethylhexyl)amino]methylphosphonic acid IUPAC Name: [phosphonomethyl(3,5,5-trimethylhexyl)amino]methylphosphonic acid Traditional Name: [phosphonomethyl(3,5,5-trimethylhexyl)amino]methylphosphonic acid Formula: C11H27NO6P2 MolecularWeight: 331.282702

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN(CP(=O)(O)O)CP(=O)(O)O)CC(C)(C)C

Isomeric SMILES

CC(CCN(CP(=O)(O)O)CP(=O)(O)O)CC(C)(C)C

InChI

InChI=1S/C11H27NO6P2/c1-10(7-11(2,3)4)5-6-12(8-19(13,14)15)9-20(16,17)18/h10H,5-9H2,1-4H3,(H2,13,14,15)(H2,16,17,18)