[(1R,2R,5S)-5-methyl-2-trimethylsilyl-cyclohexyl] 2,4-dinitrobenzoate

Systemtic Name: [(1R,2R,5S)-5-methyl-2-trimethylsilyl-cyclohexyl] 2,4-dinitrobenzoate Openeye Name: [(1R,2R,5S)-5-methyl-2-trimethylsilyl-cyclohexyl] 2,4-dinitrobenzoate CAS Name: 2,4-dinitrobenzoic acid [(1R,2R,5S)-5-methyl-2-trimethylsilylcyclohexyl] ester IUPAC Name: [(1R,2R,5S)-5-methyl-2-trimethylsilylcyclohexyl] 2,4-dinitrobenzoate Traditional Name: 2,4-dinitrobenzoic acid [(1R,2R,5S)-5-methyl-2-trimethylsilyl-cyclohexyl] ester Formula: C17H24N2O6Si MolecularWeight: 380.46776

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[Si](C)(C)C

Isomeric SMILES

C[C@H]1CC[C@H]([C@@H](C1)OC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[Si](C)(C)C

InChI

InChI=1S/C17H24N2O6Si/c1-11-5-8-16(26(2,3)4)15(9-11)25-17(20)13-7-6-12(18(21)22)10-14(13)19(23)24/h6-7,10-11,15-16H,5,8-9H2,1-4H3/t11-,15+,16+/m0/s1