6-azanyl-5-[(1R,2S,5R)-5-(hydroxymethyl)-2-oxidanyl-cyclohexyl]-1H-pyrimidin-2-one

Systemtic Name: 6-azanyl-5-[(1R,2S,5R)-5-(hydroxymethyl)-2-oxidanyl-cyclohexyl]-1H-pyrimidin-2-one Openeye Name: 6-amino-5-[(1R,2S,5R)-2-hydroxy-5-(hydroxymethyl)cyclohexyl]-1H-pyrimidin-2-one CAS Name: 6-amino-5-[(1R,2S,5R)-2-hydroxy-5-(hydroxymethyl)cyclohexyl]-1H-pyrimidin-2-one IUPAC Name: 6-amino-5-[(1R,2S,5R)-2-hydroxy-5-(hydroxymethyl)cyclohexyl]-1H-pyrimidin-2-one Traditional Name: 6-amino-5-[(1R,2S,5R)-2-hydroxy-5-methylol-cyclohexyl]-1H-pyrimidin-2-one Formula: C11H17N3O3 MolecularWeight: 239.27098

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(CC1CO)C2=C(NC(=O)N=C2)N)O

Isomeric SMILES

C1C[C@@H]([C@H](C[C@@H]1CO)C2=C(NC(=O)N=C2)N)O

InChI

InChI=1S/C11H17N3O3/c12-10-8(4-13-11(17)14-10)7-3-6(5-15)1-2-9(7)16/h4,6-7,9,15-16H,1-3,5H2,(H3,12,13,14,17)/t6-,7-,9+/m1/s1