[1-[bis(hydroxymethyl)amino]-1-phosphono-butyl]phosphonic acid

Systemtic Name: [1-[bis(hydroxymethyl)amino]-1-phosphono-butyl]phosphonic acid Openeye Name: [1-[bis(hydroxymethyl)amino]-1-phosphono-butyl]phosphonic acid CAS Name: [1-[bis(hydroxymethyl)amino]-1-phosphonobutyl]phosphonic acid IUPAC Name: [1-[bis(hydroxymethyl)amino]-1-phosphonobutyl]phosphonic acid Traditional Name: [1-(dimethylolamino)-1-phosphono-butyl]phosphonic acid Formula: C6H17NO8P2 MolecularWeight: 293.148602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(N(CO)CO)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCCC(N(CO)CO)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C6H17NO8P2/c1-2-3-6(16(10,11)12,17(13,14)15)7(4-8)5-9/h8-9H,2-5H2,1H3,(H2,10,11,12)(H2,13,14,15)