6,8-bis(iodanyl)-3,3-bis(piperidin-1-ylmethyl)-2,4-dihydrochromen-4-ol dihydrochloride

Systemtic Name: 6,8-bis(iodanyl)-3,3-bis(piperidin-1-ylmethyl)-2,4-dihydrochromen-4-ol dihydrochloride Openeye Name: 6,8-diiodo-3,3-bis(1-piperidylmethyl)chroman-4-ol dihydrochloride CAS Name: 6,8-diiodo-3,3-bis(1-piperidinylmethyl)-3,4-dihydro-2H-1-benzopyran-4-ol dihydrochloride IUPAC Name: 6,8-diiodo-3,3-bis(piperidin-1-ylmethyl)-2,4-dihydrochromen-4-ol dihydrochloride Traditional Name: 6,8-diiodo-3,3-bis(piperidinomethyl)chroman-4-ol dihydrochloride Formula: C21H32Cl2I2N2O2 MolecularWeight: 669.20592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2(COC3=C(C=C(C=C3C2O)I)I)CN4CCCCC4.Cl.Cl

Isomeric SMILES

C1CCN(CC1)CC2(COC3=C(C=C(C=C3C2O)I)I)CN4CCCCC4.Cl.Cl

InChI

InChI=1S/C21H30I2N2O2.2ClH/c22-16-11-17-19(18(23)12-16)27-15-21(20(17)26,13-24-7-3-1-4-8-24)14-25-9-5-2-6-10-25;;/h11-12,20,26H,1-10,13-15H2;2*1H