2-(nitromethyl)-3,5-bis(oxidanyl)-5-(2-trimethylsilylethynyl)cyclohexane-1-carboxylate; prop-1-en-2-olate

Systemtic Name: 2-(nitromethyl)-3,5-bis(oxidanyl)-5-(2-trimethylsilylethynyl)cyclohexane-1-carboxylate; prop-1-en-2-olate Openeye Name: 3,5-dihydroxy-2-(nitromethyl)-5-(2-trimethylsilylethynyl)cyclohexanecarboxylate; prop-1-en-2-olate CAS Name: 3,5-dihydroxy-2-(nitromethyl)-5-(2-trimethylsilylethynyl)-1-cyclohexanecarboxylate; 1-propen-2-olate IUPAC Name: 3,5-dihydroxy-2-(nitromethyl)-5-(2-trimethylsilylethynyl)cyclohexane-1-carboxylate; prop-1-en-2-olate Traditional Name: 3,5-dihydroxy-2-(nitromethyl)-5-(2-trimethylsilylethynyl)cyclohexanecarboxylate; prop-1-en-2-olate Formula: C16H25NO7Si-2 MolecularWeight: 371.4577

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21NO6Si.C3H6O/c1-21(2,3)5-4-13(18)6-9(12(16)17)10(8-14(19)20)11(15)7-13;1-3(2)4/h9-11,15,18H,6-8H2,1-3H3,(H,16,17);4H,1H2,2H3/p-2