N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-3-methyl-5-nitro-imidazol-4-amine

Systemtic Name: N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-3-methyl-5-nitro-imidazol-4-amine Openeye Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-3-methyl-5-nitro-imidazol-4-amine CAS Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-3-methyl-5-nitro-4-imidazolamine IUPAC Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-3-methyl-5-nitroimidazol-4-amine Traditional Name: 2-(2-bromo-4,5-dimethoxy-phenyl)ethyl-(3-methyl-5-nitro-imidazol-4-yl)amine Formula: C14H17BrN4O4 MolecularWeight: 385.21318

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1NCCC2=CC(=C(C=C2Br)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1NCCC2=CC(=C(C=C2Br)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C14H17BrN4O4/c1-18-8-17-14(19(20)21)13(18)16-5-4-9-6-11(22-2)12(23-3)7-10(9)15/h6-8,16H,4-5H2,1-3H3