[3-[4-(4-methylphenyl)piperidin-1-yl]-1-oxidanyl-1-phosphono-propyl]phosphonic acid

Systemtic Name: [3-[4-(4-methylphenyl)piperidin-1-yl]-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [1-hydroxy-1-phosphono-3-[4-(p-tolyl)-1-piperidyl]propyl]phosphonic acid CAS Name: [1-hydroxy-3-[4-(4-methylphenyl)-1-piperidinyl]-1-phosphonopropyl]phosphonic acid IUPAC Name: [1-hydroxy-3-[4-(4-methylphenyl)piperidin-1-yl]-1-phosphonopropyl]phosphonic acid Traditional Name: [1-hydroxy-1-phosphono-3-[4-(p-tolyl)piperidino]propyl]phosphonic acid Formula: C15H25NO7P2 MolecularWeight: 393.309022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CCN(CC2)CCC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2CCN(CC2)CCC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C15H25NO7P2/c1-12-2-4-13(5-3-12)14-6-9-16(10-7-14)11-8-15(17,24(18,19)20)25(21,22)23/h2-5,14,17H,6-11H2,1H3,(H2,18,19,20)(H2,21,22,23)