[4-[5-chloranyl-6-(4-ethyl-2-methyl-piperazin-1-yl)-1-(2-trimethylsilylethoxymethyl)benzimidazol-1-ium-1-yl]carbonyl-4-methyl-cyclohexyl] benzoate

Systemtic Name: [4-[5-chloranyl-6-(4-ethyl-2-methyl-piperazin-1-yl)-1-(2-trimethylsilylethoxymethyl)benzimidazol-1-ium-1-yl]carbonyl-4-methyl-cyclohexyl] benzoate Openeye Name: [4-[5-chloro-6-(4-ethyl-2-methyl-piperazin-1-yl)-1-(2-trimethylsilylethoxymethyl)benzimidazol-1-ium-1-carbonyl]-4-methyl-cyclohexyl] benzoate CAS Name: benzoic acid [4-[[5-chloro-6-(4-ethyl-2-methyl-1-piperazinyl)-1-(2-trimethylsilylethoxymethyl)-1-benzimidazol-1-iumyl]-oxomethyl]-4-methylcyclohexyl] ester IUPAC Name: [4-[5-chloro-6-(4-ethyl-2-methylpiperazin-1-yl)-1-(2-trimethylsilylethoxymethyl)benzimidazol-1-ium-1-carbonyl]-4-methylcyclohexyl] benzoate Traditional Name: benzoic acid [4-[5-chloro-6-(4-ethyl-2-methyl-piperazino)-1-(2-trimethylsilylethoxymethyl)benzimidazol-1-ium-1-carbonyl]-4-methyl-cyclohexyl] ester Formula: C35H50ClN4O4Si+ MolecularWeight: 654.3344

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(C(C1)C)C2=C(C=C3C(=C2)[N+](C=N3)(COCC[Si](C)(C)C)C(=O)C4(CCC(CC4)OC(=O)C5=CC=CC=C5)C)Cl

Isomeric SMILES

CCN1CCN(C(C1)C)C2=C(C=C3C(=C2)[N+](C=N3)(COCC[Si](C)(C)C)C(=O)C4(CCC(CC4)OC(=O)C5=CC=CC=C5)C)Cl

InChI

InChI=1S/C35H50ClN4O4Si/c1-7-38-17-18-39(26(2)23-38)31-22-32-30(21-29(31)36)37-24-40(32,25-43-19-20-45(4,5)6)34(42)35(3)15-13-28(14-16-35)44-33(41)27-11-9-8-10-12-27/h8-12,21-22,24,26,28H,7,13-20,23,25H2,1-6H3/q+1