2-[(1-azido-3-oxidanyl-propan-2-yl)oxymethyl]-6-methyl-1,2,4-triazine-3,5-dione

Systemtic Name: 2-[(1-azido-3-oxidanyl-propan-2-yl)oxymethyl]-6-methyl-1,2,4-triazine-3,5-dione Openeye Name: 2-[[1-(azidomethyl)-2-hydroxy-ethoxy]methyl]-6-methyl-1,2,4-triazine-3,5-dione CAS Name: 2-[(1-azido-3-hydroxypropan-2-yl)oxymethyl]-6-methyl-1,2,4-triazine-3,5-dione IUPAC Name: 2-[(1-azido-3-hydroxypropan-2-yl)oxymethyl]-6-methyl-1,2,4-triazine-3,5-dione Traditional Name: 2-[[1-(azidomethyl)-2-hydroxy-ethoxy]methyl]-6-methyl-1,2,4-triazine-3,5-quinone Formula: C8H12N6O4 MolecularWeight: 256.21868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)NC1=O)COC(CN=[N+]=[N-])CO

Isomeric SMILES

CC1=NN(C(=O)NC1=O)COC(CN=[N+]=[N-])CO

InChI

InChI=1S/C8H12N6O4/c1-5-7(16)11-8(17)14(12-5)4-18-6(3-15)2-10-13-9/h6,15H,2-4H2,1H3,(H,11,16,17)