[5-(hydroxymethyl)-2-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-4-oxidanyl-oxolan-3-yl] benzoate

Systemtic Name: [5-(hydroxymethyl)-2-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-4-oxidanyl-oxolan-3-yl] benzoate Openeye Name: [4-hydroxy-5-(hydroxymethyl)-2-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-3-yl] benzoate CAS Name: benzoic acid [4-hydroxy-5-(hydroxymethyl)-2-(5-methyl-2,4-dioxo-1-pyrimidinyl)-3-oxolanyl] ester IUPAC Name: [4-hydroxy-5-(hydroxymethyl)-2-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] benzoate Traditional Name: benzoic acid [2-(2,4-diketo-5-methyl-pyrimidin-1-yl)-4-hydroxy-5-methylol-tetrahydrofuran-3-yl] ester Formula: C17H18N2O7 MolecularWeight: 362.33402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2C(C(C(O2)CO)O)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CN(C(=O)NC1=O)C2C(C(C(O2)CO)O)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H18N2O7/c1-9-7-19(17(24)18-14(9)22)15-13(12(21)11(8-20)25-15)26-16(23)10-5-3-2-4-6-10/h2-7,11-13,15,20-21H,8H2,1H3,(H,18,22,24)