(2,6-ditert-butyl-4-methyl-phenyl) (2S,3R)-3-(4-tert-butylphenyl)oxirane-2-carboxylate

Systemtic Name: (2,6-ditert-butyl-4-methyl-phenyl) (2S,3R)-3-(4-tert-butylphenyl)oxirane-2-carboxylate Openeye Name: (2,6-ditert-butyl-4-methyl-phenyl) (2S,3R)-3-(4-tert-butylphenyl)oxirane-2-carboxylate CAS Name: (2S,3R)-3-(4-tert-butylphenyl)-2-oxiranecarboxylic acid (2,6-ditert-butyl-4-methylphenyl) ester IUPAC Name: (2,6-ditert-butyl-4-methylphenyl) (2S,3R)-3-(4-tert-butylphenyl)oxirane-2-carboxylate Traditional Name: (2S,3R)-3-(4-tert-butylphenyl)oxirane-2-carboxylic acid (2,6-ditert-butyl-4-methyl-phenyl) ester Formula: C28H38O3 MolecularWeight: 422.59952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(C)(C)C)OC(=O)C2C(O2)C3=CC=C(C=C3)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C(C)(C)C)OC(=O)[C@@H]2[C@H](O2)C3=CC=C(C=C3)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C28H38O3/c1-17-15-20(27(5,6)7)23(21(16-17)28(8,9)10)31-25(29)24-22(30-24)18-11-13-19(14-12-18)26(2,3)4/h11-16,22,24H,1-10H3/t22-,24+/m1/s1