4-[4-(hydroxymethyl)furan-3-yl]-5-methoxy-2-methyl-1,2,4-triazol-3-one

Systemtic Name: 4-[4-(hydroxymethyl)furan-3-yl]-5-methoxy-2-methyl-1,2,4-triazol-3-one Openeye Name: 4-[4-(hydroxymethyl)-3-furyl]-5-methoxy-2-methyl-1,2,4-triazol-3-one CAS Name: 4-[4-(hydroxymethyl)-3-furanyl]-5-methoxy-2-methyl-1,2,4-triazol-3-one IUPAC Name: 4-[4-(hydroxymethyl)furan-3-yl]-5-methoxy-2-methyl-1,2,4-triazol-3-one Traditional Name: 5-methoxy-2-methyl-4-(4-methylol-3-furyl)-1,2,4-triazol-3-one Formula: C9H11N3O4 MolecularWeight: 225.20134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)N(C(=N1)OC)C2=COC=C2CO

Isomeric SMILES

CN1C(=O)N(C(=N1)OC)C2=COC=C2CO

InChI

InChI=1S/C9H11N3O4/c1-11-9(14)12(8(10-11)15-2)7-5-16-4-6(7)3-13/h4-5,13H,3H2,1-2H3