O2-tert-butyl O5-(5-methyl-2-propan-2-yl-cyclohexyl) (3S,4R)-4-phenyl-3-trimethylsilyl-3,4-dihydropyrazole-2,5-dicarboxylate

Systemtic Name: O2-tert-butyl O5-(5-methyl-2-propan-2-yl-cyclohexyl) (3S,4R)-4-phenyl-3-trimethylsilyl-3,4-dihydropyrazole-2,5-dicarboxylate Openeye Name: O2-tert-butyl O5-(2-isopropyl-5-methyl-cyclohexyl) (3S,4R)-4-phenyl-3-trimethylsilyl-3,4-dihydropyrazole-2,5-dicarboxylate CAS Name: (3S,4R)-4-phenyl-3-trimethylsilyl-3,4-dihydropyrazole-2,5-dicarboxylic acid O2-tert-butyl ester O5-(5-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: 2-O-tert-butyl 5-O-(5-methyl-2-propan-2-ylcyclohexyl) (3S,4R)-4-phenyl-3-trimethylsilyl-3,4-dihydropyrazole-2,5-dicarboxylate Traditional Name: (4R,5S)-4-phenyl-5-trimethylsilyl-2-pyrazoline-1,3-dicarboxylic acid O1-tert-butyl ester O3-(2-isopropyl-5-methyl-cyclohexyl) ester Formula: C28H44N2O4Si MolecularWeight: 500.74546

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2=NN(C(C2C3=CC=CC=C3)[Si](C)(C)C)C(=O)OC(C)(C)C)C(C)C

Isomeric SMILES

CC1CCC(C(C1)OC(=O)C2=NN([C@H]([C@@H]2C3=CC=CC=C3)[Si](C)(C)C)C(=O)OC(C)(C)C)C(C)C

InChI

InChI=1S/C28H44N2O4Si/c1-18(2)21-16-15-19(3)17-22(21)33-26(31)24-23(20-13-11-10-12-14-20)25(35(7,8)9)30(29-24)27(32)34-28(4,5)6/h10-14,18-19,21-23,25H,15-17H2,1-9H3/t19?,21?,22?,23-,25+/m1/s1