1-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-2-(2-methylbenzimidazol-1-yl)ethanone

Systemtic Name: 1-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-2-(2-methylbenzimidazol-1-yl)ethanone Openeye Name: 1-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-2-(2-methylbenzimidazol-1-yl)ethanone CAS Name: 1-[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-2-(2-methyl-1-benzimidazolyl)ethanone IUPAC Name: 1-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-2-(2-methylbenzimidazol-1-yl)ethanone Traditional Name: 1-[4-(4-chloro-2-nitro-phenyl)piperazino]-2-(2-methylbenzimidazol-1-yl)ethanone Formula: C20H20ClN5O3 MolecularWeight: 413.8575

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N1CC(=O)N3CCN(CC3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2N1CC(=O)N3CCN(CC3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H20ClN5O3/c1-14-22-16-4-2-3-5-17(16)25(14)13-20(27)24-10-8-23(9-11-24)18-7-6-15(21)12-19(18)26(28)29/h2-7,12H,8-11,13H2,1H3