[3-[methyl(3-pyridin-2-ylpropyl)amino]-1-oxidanyl-1-phosphono-propyl]phosphonic acid

Systemtic Name: [3-[methyl(3-pyridin-2-ylpropyl)amino]-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [1-hydroxy-3-[methyl-[3-(2-pyridyl)propyl]amino]-1-phosphono-propyl]phosphonic acid CAS Name: [1-hydroxy-3-[methyl-[3-(2-pyridinyl)propyl]amino]-1-phosphonopropyl]phosphonic acid IUPAC Name: [1-hydroxy-3-[methyl(3-pyridin-2-ylpropyl)amino]-1-phosphonopropyl]phosphonic acid Traditional Name: [1-hydroxy-3-[methyl-[3-(2-pyridyl)propyl]amino]-1-phosphono-propyl]phosphonic acid Formula: C12H22N2O7P2 MolecularWeight: 368.259802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1=CC=CC=N1)CCC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CN(CCCC1=CC=CC=N1)CCC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C12H22N2O7P2/c1-14(9-4-6-11-5-2-3-8-13-11)10-7-12(15,22(16,17)18)23(19,20)21/h2-3,5,8,15H,4,6-7,9-10H2,1H3,(H2,16,17,18)(H2,19,20,21)