[3-[methyl(4-pyridin-2-ylbutyl)amino]-1-oxidanyl-1-phosphono-propyl]phosphonic acid

Systemtic Name: [3-[methyl(4-pyridin-2-ylbutyl)amino]-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [1-hydroxy-3-[methyl-[4-(2-pyridyl)butyl]amino]-1-phosphono-propyl]phosphonic acid CAS Name: [1-hydroxy-3-[methyl-[4-(2-pyridinyl)butyl]amino]-1-phosphonopropyl]phosphonic acid IUPAC Name: [1-hydroxy-3-[methyl(4-pyridin-2-ylbutyl)amino]-1-phosphonopropyl]phosphonic acid Traditional Name: [1-hydroxy-3-[methyl-[4-(2-pyridyl)butyl]amino]-1-phosphono-propyl]phosphonic acid Formula: C13H24N2O7P2 MolecularWeight: 382.286382

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCC1=CC=CC=N1)CCC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CN(CCCCC1=CC=CC=N1)CCC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C13H24N2O7P2/c1-15(10-5-3-7-12-6-2-4-9-14-12)11-8-13(16,23(17,18)19)24(20,21)22/h2,4,6,9,16H,3,5,7-8,10-11H2,1H3,(H2,17,18,19)(H2,20,21,22)