4-azanyl-1-[5-(hydroxymethyl)-4-nonyl-3,4-bis(oxidanyl)oxolan-2-yl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[5-(hydroxymethyl)-4-nonyl-3,4-bis(oxidanyl)oxolan-2-yl]pyrimidin-2-one Openeye Name: 4-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)-4-nonyl-tetrahydrofuran-2-yl]pyrimidin-2-one CAS Name: 4-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)-4-nonyl-2-oxolanyl]-2-pyrimidinone IUPAC Name: 4-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)-4-nonyloxolan-2-yl]pyrimidin-2-one Traditional Name: 4-amino-1-(3,4-dihydroxy-5-methylol-4-nonyl-tetrahydrofuran-2-yl)pyrimidin-2-one Formula: C18H31N3O5 MolecularWeight: 369.45584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1(C(OC(C1O)N2C=CC(=NC2=O)N)CO)O

Isomeric SMILES

CCCCCCCCCC1(C(OC(C1O)N2C=CC(=NC2=O)N)CO)O

InChI

InChI=1S/C18H31N3O5/c1-2-3-4-5-6-7-8-10-18(25)13(12-22)26-16(15(18)23)21-11-9-14(19)20-17(21)24/h9,11,13,15-16,22-23,25H,2-8,10,12H2,1H3,(H2,19,20,24)