1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-5-methyl-1-(phenylmethoxymethyl)pyrimidin-1-ium-2,4-dione

Systemtic Name: 1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-5-methyl-1-(phenylmethoxymethyl)pyrimidin-1-ium-2,4-dione Openeye Name: 1-(benzyloxymethyl)-1-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidin-1-ium-2,4-dione CAS Name: 1-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-5-methyl-1-(phenylmethoxymethyl)pyrimidin-1-ium-2,4-dione IUPAC Name: 1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-1-(phenylmethoxymethyl)pyrimidin-1-ium-2,4-dione Traditional Name: 1-(benzoxymethyl)-1-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)-5-methyl-pyrimidin-1-ium-2,4-quinone Formula: C18H23N2O6+ MolecularWeight: 363.38502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](C(=O)NC1=O)(COCC2=CC=CC=C2)C3CC(C(O3)CO)O

Isomeric SMILES

CC1=C[N+](C(=O)NC1=O)(COCC2=CC=CC=C2)C3CC(C(O3)CO)O

InChI

InChI=1S/C18H22N2O6/c1-12-8-20(18(24)19-17(12)23,16-7-14(22)15(9-21)26-16)11-25-10-13-5-3-2-4-6-13/h2-6,8,14-16,21-22H,7,9-11H2,1H3/p+1