4-azanyl-1-[5-(hydroxymethyl)-3-oxidanyl-oxolan-2-yl]-5-non-1-ynyl-pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[5-(hydroxymethyl)-3-oxidanyl-oxolan-2-yl]-5-non-1-ynyl-pyrimidin-2-one Openeye Name: 4-amino-1-[3-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-non-1-ynyl-pyrimidin-2-one CAS Name: 4-amino-1-[3-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-5-non-1-ynyl-2-pyrimidinone IUPAC Name: 4-amino-1-[3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-non-1-ynylpyrimidin-2-one Traditional Name: 4-amino-1-(3-hydroxy-5-methylol-tetrahydrofuran-2-yl)-5-non-1-ynyl-pyrimidin-2-one Formula: C18H27N3O4 MolecularWeight: 349.42468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC#CC1=CN(C(=O)N=C1N)C2C(CC(O2)CO)O

Isomeric SMILES

CCCCCCCC#CC1=CN(C(=O)N=C1N)C2C(CC(O2)CO)O

InChI

InChI=1S/C18H27N3O4/c1-2-3-4-5-6-7-8-9-13-11-21(18(24)20-16(13)19)17-15(23)10-14(12-22)25-17/h11,14-15,17,22-23H,2-7,10,12H2,1H3,(H2,19,20,24)