cyclohexyl-[(4,4-dimethylpiperazin-4-ium-1-yl)methyl]-oxidanyl-phenyl-silane; methyl sulfate

Systemtic Name: cyclohexyl-[(4,4-dimethylpiperazin-4-ium-1-yl)methyl]-oxidanyl-phenyl-silane; methyl sulfate Openeye Name: cyclohexyl-[(4,4-dimethylpiperazin-4-ium-1-yl)methyl]-hydroxy-phenyl-silane; methyl sulfate CAS Name: cyclohexyl-[(4,4-dimethyl-1-piperazin-4-iumyl)methyl]-hydroxy-phenylsilane; methyl sulfate IUPAC Name: cyclohexyl-[(4,4-dimethylpiperazin-4-ium-1-yl)methyl]-hydroxy-phenylsilane; methyl sulfate Traditional Name: cyclohexyl-[(4,4-dimethylpiperazin-4-ium-1-yl)methyl]-hydroxy-phenyl-silane; methyl sulfate Formula: C20H36N2O5SSi MolecularWeight: 444.66074

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(CC1)C[Si](C2CCCCC2)(C3=CC=CC=C3)O)C.COS(=O)(=O)[O-]

Isomeric SMILES

C[N+]1(CCN(CC1)C[Si](C2CCCCC2)(C3=CC=CC=C3)O)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C19H33N2OSi.CH4O4S/c1-21(2)15-13-20(14-16-21)17-23(22,18-9-5-3-6-10-18)19-11-7-4-8-12-19;1-5-6(2,3)4/h3,5-6,9-10,19,22H,4,7-8,11-17H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1