3-iodanyl-2-(oxan-2-yl)-7-(oxan-2-yloxy)-4,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-2-ium

Systemtic Name: 3-iodanyl-2-(oxan-2-yl)-7-(oxan-2-yloxy)-4,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-2-ium Openeye Name: 3-iodo-2-tetrahydropyran-2-yl-7-tetrahydropyran-2-yloxy-4,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-2-ium CAS Name: 3-iodo-2-(2-oxanyl)-7-(2-oxanyloxy)-4,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-2-ium IUPAC Name: 3-iodo-2-(oxan-2-yl)-7-(oxan-2-yloxy)-4,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-2-ium Traditional Name: 3-iodo-2-tetrahydropyran-2-yl-7-tetrahydropyran-2-yloxy-4,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-2-ium Formula: C15H22IN4O3+ MolecularWeight: 433.26465

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)[N+]2=C(C3=C(N2)C(N=CN3)OC4CCCCO4)I

Isomeric SMILES

C1CCOC(C1)[N+]2=C(C3=C(N2)C(N=CN3)OC4CCCCO4)I

InChI

InChI=1S/C15H21IN4O3/c16-14-12-13(19-20(14)10-5-1-3-7-21-10)15(18-9-17-12)23-11-6-2-4-8-22-11/h9-11,15H,1-8H2,(H,17,18)/p+1