2-(nitromethyl)-3,5-bis(oxidanyl)-5-(2-trimethylsilylethynyl)cyclohexane-1-carboxylic acid

Systemtic Name: 2-(nitromethyl)-3,5-bis(oxidanyl)-5-(2-trimethylsilylethynyl)cyclohexane-1-carboxylic acid Openeye Name: 3,5-dihydroxy-2-(nitromethyl)-5-(2-trimethylsilylethynyl)cyclohexanecarboxylic acid CAS Name: 3,5-dihydroxy-2-(nitromethyl)-5-(2-trimethylsilylethynyl)-1-cyclohexanecarboxylic acid IUPAC Name: 3,5-dihydroxy-2-(nitromethyl)-5-(2-trimethylsilylethynyl)cyclohexane-1-carboxylic acid Traditional Name: 3,5-dihydroxy-2-(nitromethyl)-5-(2-trimethylsilylethynyl)cyclohexanecarboxylic acid Formula: C13H21NO6Si MolecularWeight: 315.39444

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Descriptors Computed from Structure

Canonical SMILES:

C[Si](C)(C)C#CC1(CC(C(C(C1)O)C[N+](=O)[O-])C(=O)O)O

Isomeric SMILES

C[Si](C)(C)C#CC1(CC(C(C(C1)O)C[N+](=O)[O-])C(=O)O)O

InChI

InChI=1S/C13H21NO6Si/c1-21(2,3)5-4-13(18)6-9(12(16)17)10(8-14(19)20)11(15)7-13/h9-11,15,18H,6-8H2,1-3H3,(H,16,17)