N-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-(3-nitro-1,2,4-triazol-1-yl)butanamide

Systemtic Name: N-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-(3-nitro-1,2,4-triazol-1-yl)butanamide Openeye Name: N-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-(3-nitro-1,2,4-triazol-1-yl)butanamide CAS Name: N-[2-(2-methyl-5-nitro-1-imidazolyl)ethyl]-4-(3-nitro-1,2,4-triazol-1-yl)butanamide IUPAC Name: N-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]-4-(3-nitro-1,2,4-triazol-1-yl)butanamide Traditional Name: N-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-(3-nitro-1,2,4-triazol-1-yl)butyramide Formula: C12H16N8O5 MolecularWeight: 352.30604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCNC(=O)CCCN2C=NC(=N2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCNC(=O)CCCN2C=NC(=N2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H16N8O5/c1-9-14-7-11(19(22)23)18(9)6-4-13-10(21)3-2-5-17-8-15-12(16-17)20(24)25/h7-8H,2-6H2,1H3,(H,13,21)