[(1R,2S)-2-(2-phenylpropan-2-yl)cyclohexyl] 4-methoxy-3-tri(propan-2-yl)silyl-pyridin-1-ium-1-carboxylate

Systemtic Name: [(1R,2S)-2-(2-phenylpropan-2-yl)cyclohexyl] 4-methoxy-3-tri(propan-2-yl)silyl-pyridin-1-ium-1-carboxylate Openeye Name: [(1R,2S)-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] 4-methoxy-3-triisopropylsilyl-pyridin-1-ium-1-carboxylate CAS Name: 4-methoxy-3-tri(propan-2-yl)silyl-1-pyridin-1-iumcarboxylic acid [(1R,2S)-2-(2-phenylpropan-2-yl)cyclohexyl] ester IUPAC Name: [(1R,2S)-2-(2-phenylpropan-2-yl)cyclohexyl] 4-methoxy-3-tri(propan-2-yl)silylpyridin-1-ium-1-carboxylate Traditional Name: 4-methoxy-3-triisopropylsilyl-pyridin-1-ium-1-carboxylic acid [(1R,2S)-2-cumylcyclohexyl] ester Formula: C31H48NO3Si+ MolecularWeight: 510.80322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[Si](C1=C(C=C[N+](=C1)C(=O)OC2CCCCC2C(C)(C)C3=CC=CC=C3)OC)(C(C)C)C(C)C

Isomeric SMILES

CC(C)[Si](C1=C(C=C[N+](=C1)C(=O)O[C@@H]2CCCC[C@H]2C(C)(C)C3=CC=CC=C3)OC)(C(C)C)C(C)C

InChI

InChI=1S/C31H48NO3Si/c1-22(2)36(23(3)4,24(5)6)29-21-32(20-19-28(29)34-9)30(33)35-27-18-14-13-17-26(27)31(7,8)25-15-11-10-12-16-25/h10-12,15-16,19-24,26-27H,13-14,17-18H2,1-9H3/q+1/t26-,27-/m1/s1