N-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-3-(2-nitroimidazol-1-yl)propan-1-amine hydrochloride

Systemtic Name: N-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-3-(2-nitroimidazol-1-yl)propan-1-amine hydrochloride Openeye Name: N-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-3-(2-nitroimidazol-1-yl)propan-1-amine hydrochloride CAS Name: N-[2-(2-methyl-5-nitro-1-imidazolyl)ethyl]-3-(2-nitro-1-imidazolyl)-1-propanamine hydrochloride IUPAC Name: N-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]-3-(2-nitroimidazol-1-yl)propan-1-amine hydrochloride Traditional Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl-[3-(2-nitroimidazol-1-yl)propyl]amine hydrochloride Formula: C12H18ClN7O4 MolecularWeight: 359.76882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCNCCCN2C=CN=C2[N+](=O)[O-])[N+](=O)[O-].Cl

Isomeric SMILES

CC1=NC=C(N1CCNCCCN2C=CN=C2[N+](=O)[O-])[N+](=O)[O-].Cl

InChI

InChI=1S/C12H17N7O4.ClH/c1-10-15-9-11(18(20)21)17(10)8-4-13-3-2-6-16-7-5-14-12(16)19(22)23;/h5,7,9,13H,2-4,6,8H2,1H3;1H