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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(O)(P(=O)(O)O)P(=O)(O)O)N(C)CCCC1=CC=CC=N1

Isomeric SMILES

CC(C(O)(P(=O)(O)O)P(=O)(O)O)N(C)CCCC1=CC=CC=N1

InChI

InChI=1S/C12H22N2O7P2/c1-10(12(15,22(16,17)18)23(19,20)21)14(2)9-5-7-11-6-3-4-8-13-11/h3-4,6,8,10,15H,5,7,9H2,1-2H3,(H2,16,17,18)(H2,19,20,21)