[(1R,2S,5S)-5-tert-butyl-2-trimethylsilyl-cyclohexyl] 4-nitrobenzoate

Systemtic Name: [(1R,2S,5S)-5-tert-butyl-2-trimethylsilyl-cyclohexyl] 4-nitrobenzoate Openeye Name: [(1R,2S,5S)-5-tert-butyl-2-trimethylsilyl-cyclohexyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(1R,2S,5S)-5-tert-butyl-2-trimethylsilylcyclohexyl] ester IUPAC Name: [(1R,2S,5S)-5-tert-butyl-2-trimethylsilylcyclohexyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(1R,2S,5S)-5-tert-butyl-2-trimethylsilyl-cyclohexyl] ester Formula: C20H31NO4Si MolecularWeight: 377.54994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(C(C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])[Si](C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C20H31NO4Si/c1-20(2,3)15-9-12-18(26(4,5)6)17(13-15)25-19(22)14-7-10-16(11-8-14)21(23)24/h7-8,10-11,15,17-18H,9,12-13H2,1-6H3/t15-,17+,18-/m0/s1