1-[3,4-bis(hydroxymethyl)cyclohexyl]-5-iodanyl-pyrimidine-2,4-dione

Systemtic Name: 1-[3,4-bis(hydroxymethyl)cyclohexyl]-5-iodanyl-pyrimidine-2,4-dione Openeye Name: 1-[3,4-bis(hydroxymethyl)cyclohexyl]-5-iodo-pyrimidine-2,4-dione CAS Name: 1-[3,4-bis(hydroxymethyl)cyclohexyl]-5-iodopyrimidine-2,4-dione IUPAC Name: 1-[3,4-bis(hydroxymethyl)cyclohexyl]-5-iodopyrimidine-2,4-dione Traditional Name: 1-(3,4-dimethylolcyclohexyl)-5-iodo-pyrimidine-2,4-quinone Formula: C12H17IN2O4 MolecularWeight: 380.17885

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(CC1N2C=C(C(=O)NC2=O)I)CO)CO

Isomeric SMILES

C1CC(C(CC1N2C=C(C(=O)NC2=O)I)CO)CO

InChI

InChI=1S/C12H17IN2O4/c13-10-4-15(12(19)14-11(10)18)9-2-1-7(5-16)8(3-9)6-17/h4,7-9,16-17H,1-3,5-6H2,(H,14,18,19)