1-[(1R,2R)-4,4-bis(hydroxymethyl)-2-oxidanyl-cyclohexyl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[(1R,2R)-4,4-bis(hydroxymethyl)-2-oxidanyl-cyclohexyl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 1-[(1R,2R)-2-hydroxy-4,4-bis(hydroxymethyl)cyclohexyl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[(1R,2R)-2-hydroxy-4,4-bis(hydroxymethyl)cyclohexyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[(1R,2R)-2-hydroxy-4,4-bis(hydroxymethyl)cyclohexyl]-5-methylpyrimidine-2,4-dione Traditional Name: 1-[(1R,2R)-2-hydroxy-4,4-dimethylol-cyclohexyl]-5-methyl-pyrimidine-2,4-quinone Formula: C13H20N2O5 MolecularWeight: 284.3083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2CCC(CC2O)(CO)CO

Isomeric SMILES

CC1=CN(C(=O)NC1=O)[C@@H]2CCC(C[C@H]2O)(CO)CO

InChI

InChI=1S/C13H20N2O5/c1-8-5-15(12(20)14-11(8)19)9-2-3-13(6-16,7-17)4-10(9)18/h5,9-10,16-18H,2-4,6-7H2,1H3,(H,14,19,20)/t9-,10-/m1/s1