1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]pyrimidine-2,4-dione; prop-1-yne

Systemtic Name: 1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]pyrimidine-2,4-dione; prop-1-yne Openeye Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione; prop-1-yne CAS Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]pyrimidine-2,4-dione; 1-propyne IUPAC Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione; prop-1-yne Traditional Name: 1-(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)pyrimidine-2,4-quinone; prop-1-yne Formula: C12H16N2O6 MolecularWeight: 284.26524

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Descriptors Computed from Structure

Canonical SMILES:

CC#C.C1=CN(C(=O)NC1=O)C2C(C(C(O2)CO)O)O

Isomeric SMILES

CC#C.C1=CN(C(=O)NC1=O)C2C(C(C(O2)CO)O)O

InChI

InChI=1S/C9H12N2O6.C3H4/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16;1-3-2/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16);1H,2H3