4-azanyl-1-[(1S,4R,5S)-4-(hydroxymethyl)-5-oxidanyl-cyclohex-2-en-1-yl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[(1S,4R,5S)-4-(hydroxymethyl)-5-oxidanyl-cyclohex-2-en-1-yl]pyrimidin-2-one Openeye Name: 4-amino-1-[(1S,4R,5S)-5-hydroxy-4-(hydroxymethyl)cyclohex-2-en-1-yl]pyrimidin-2-one CAS Name: 4-amino-1-[(1S,4R,5S)-5-hydroxy-4-(hydroxymethyl)-1-cyclohex-2-enyl]-2-pyrimidinone IUPAC Name: 4-amino-1-[(1S,4R,5S)-5-hydroxy-4-(hydroxymethyl)cyclohex-2-en-1-yl]pyrimidin-2-one Traditional Name: 4-amino-1-[(1S,4R,5S)-5-hydroxy-4-methylol-cyclohex-2-en-1-yl]pyrimidin-2-one Formula: C11H15N3O3 MolecularWeight: 237.2551

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=CC(C1O)CO)N2C=CC(=NC2=O)N

Isomeric SMILES

C1[C@@H](C=C[C@@H]([C@H]1O)CO)N2C=CC(=NC2=O)N

InChI

InChI=1S/C11H15N3O3/c12-10-3-4-14(11(17)13-10)8-2-1-7(6-15)9(16)5-8/h1-4,7-9,15-16H,5-6H2,(H2,12,13,17)/t7-,8-,9+/m1/s1