[1-oxidanyl-1-phosphono-3-(4-pyridin-3-ylpiperidin-1-yl)propyl]phosphonic acid

Systemtic Name: [1-oxidanyl-1-phosphono-3-(4-pyridin-3-ylpiperidin-1-yl)propyl]phosphonic acid Openeye Name: [1-hydroxy-1-phosphono-3-[4-(3-pyridyl)-1-piperidyl]propyl]phosphonic acid CAS Name: [1-hydroxy-1-phosphono-3-[4-(3-pyridinyl)-1-piperidinyl]propyl]phosphonic acid IUPAC Name: [1-hydroxy-1-phosphono-3-(4-pyridin-3-ylpiperidin-1-yl)propyl]phosphonic acid Traditional Name: [1-hydroxy-1-phosphono-3-[4-(3-pyridyl)piperidino]propyl]phosphonic acid Formula: C13H22N2O7P2 MolecularWeight: 380.270502

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CN=CC=C2)CCC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1CN(CCC1C2=CN=CC=C2)CCC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C13H22N2O7P2/c16-13(23(17,18)19,24(20,21)22)5-9-15-7-3-11(4-8-15)12-2-1-6-14-10-12/h1-2,6,10-11,16H,3-5,7-9H2,(H2,17,18,19)(H2,20,21,22)