4-[5-(3-azido-1,2,4-triazol-1-yl)-3-nitro-1,2,4-triazol-1-yl]butan-2-one

Systemtic Name: 4-[5-(3-azido-1,2,4-triazol-1-yl)-3-nitro-1,2,4-triazol-1-yl]butan-2-one Openeye Name: 4-[5-(3-azido-1,2,4-triazol-1-yl)-3-nitro-1,2,4-triazol-1-yl]butan-2-one CAS Name: 4-[5-(3-azido-1,2,4-triazol-1-yl)-3-nitro-1,2,4-triazol-1-yl]-2-butanone IUPAC Name: 4-[5-(3-azido-1,2,4-triazol-1-yl)-3-nitro-1,2,4-triazol-1-yl]butan-2-one Traditional Name: 4-[5-(3-azido-1,2,4-triazol-1-yl)-3-nitro-1,2,4-triazol-1-yl]butan-2-one Formula: C8H8N10O3 MolecularWeight: 292.21432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCN1C(=NC(=N1)[N+](=O)[O-])N2C=NC(=N2)N=[N+]=[N-]

Isomeric SMILES

CC(=O)CCN1C(=NC(=N1)[N+](=O)[O-])N2C=NC(=N2)N=[N+]=[N-]

InChI

InChI=1S/C8H8N10O3/c1-5(19)2-3-16-8(11-7(14-16)18(20)21)17-4-10-6(13-17)12-15-9/h4H,2-3H2,1H3