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

Systemtic Name: [3-[methyl(2-pyridin-4-ylethyl)amino]-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [1-hydroxy-3-[methyl-[2-(4-pyridyl)ethyl]amino]-1-phosphono-propyl]phosphonic acid CAS Name: [1-hydroxy-3-[methyl(2-pyridin-4-ylethyl)amino]-1-phosphonopropyl]phosphonic acid IUPAC Name: [1-hydroxy-3-[methyl(2-pyridin-4-ylethyl)amino]-1-phosphonopropyl]phosphonic acid Traditional Name: [1-hydroxy-3-[methyl-[2-(4-pyridyl)ethyl]amino]-1-phosphono-propyl]phosphonic acid Formula: C11H20N2O7P2 MolecularWeight: 354.233222

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=NC=C1)CCC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CN(CCC1=CC=NC=C1)CCC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C11H20N2O7P2/c1-13(8-4-10-2-6-12-7-3-10)9-5-11(14,21(15,16)17)22(18,19)20/h2-3,6-7,14H,4-5,8-9H2,1H3,(H2,15,16,17)(H2,18,19,20)