[2-oxidanyl-3-(6-piperidin-1-ylpurin-9-yl)propoxy]methylphosphonic acid

Systemtic Name: [2-oxidanyl-3-(6-piperidin-1-ylpurin-9-yl)propoxy]methylphosphonic acid Openeye Name: [2-hydroxy-3-[6-(1-piperidyl)purin-9-yl]propoxy]methylphosphonic acid CAS Name: [2-hydroxy-3-[6-(1-piperidinyl)-9-purinyl]propoxy]methylphosphonic acid IUPAC Name: [2-hydroxy-3-(6-piperidin-1-ylpurin-9-yl)propoxy]methylphosphonic acid Traditional Name: [2-hydroxy-3-(6-piperidinopurin-9-yl)propoxy]methylphosphonic acid Formula: C14H22N5O5P MolecularWeight: 371.328741

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC=NC3=C2N=CN3CC(COCP(=O)(O)O)O

Isomeric SMILES

C1CCN(CC1)C2=NC=NC3=C2N=CN3CC(COCP(=O)(O)O)O

InChI

InChI=1S/C14H22N5O5P/c20-11(7-24-10-25(21,22)23)6-19-9-17-12-13(15-8-16-14(12)19)18-4-2-1-3-5-18/h8-9,11,20H,1-7,10H2,(H2,21,22,23)