1-(2-azidoethyl)-2-[1,2-bis(bromanyl)-2-(4-bromophenyl)ethyl]-5-nitro-imidazole

Systemtic Name: 1-(2-azidoethyl)-2-[1,2-bis(bromanyl)-2-(4-bromophenyl)ethyl]-5-nitro-imidazole Openeye Name: 1-(2-azidoethyl)-2-[1,2-dibromo-2-(4-bromophenyl)ethyl]-5-nitro-imidazole CAS Name: 1-(2-azidoethyl)-2-[1,2-dibromo-2-(4-bromophenyl)ethyl]-5-nitroimidazole IUPAC Name: 1-(2-azidoethyl)-2-[1,2-dibromo-2-(4-bromophenyl)ethyl]-5-nitroimidazole Traditional Name: 1-(2-azidoethyl)-2-[1,2-dibromo-2-(4-bromophenyl)ethyl]-5-nitro-imidazole Formula: C13H11Br3N6O2 MolecularWeight: 522.97744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C(C2=NC=C(N2CCN=[N+]=[N-])[N+](=O)[O-])Br)Br)Br

Isomeric SMILES

C1=CC(=CC=C1C(C(C2=NC=C(N2CCN=[N+]=[N-])[N+](=O)[O-])Br)Br)Br

InChI

InChI=1S/C13H11Br3N6O2/c14-9-3-1-8(2-4-9)11(15)12(16)13-18-7-10(22(23)24)21(13)6-5-19-20-17/h1-4,7,11-12H,5-6H2