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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H31NO4Si/c1-20(2,3)15-9-12-17(18(13-15)26(4,5)6)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