1-[(1R,3R,4S)-4-(hydroxymethyl)-3-oxidanyl-cyclohexyl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[(1R,3R,4S)-4-(hydroxymethyl)-3-oxidanyl-cyclohexyl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 1-[(1R,3R,4S)-3-hydroxy-4-(hydroxymethyl)cyclohexyl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[(1R,3R,4S)-3-hydroxy-4-(hydroxymethyl)cyclohexyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[(1R,3R,4S)-3-hydroxy-4-(hydroxymethyl)cyclohexyl]-5-methylpyrimidine-2,4-dione Traditional Name: 1-[(1R,3R,4S)-3-hydroxy-4-methylol-cyclohexyl]-5-methyl-pyrimidine-2,4-quinone Formula: C12H18N2O4 MolecularWeight: 254.28232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2CCC(C(C2)O)CO

Isomeric SMILES

CC1=CN(C(=O)NC1=O)[C@@H]2CC[C@H]([C@@H](C2)O)CO

InChI

InChI=1S/C12H18N2O4/c1-7-5-14(12(18)13-11(7)17)9-3-2-8(6-15)10(16)4-9/h5,8-10,15-16H,2-4,6H2,1H3,(H,13,17,18)/t8-,9+,10+/m0/s1