(2,4,6-tritert-butylphenyl) (2S)-spiro[2.3]hexane-2-carboxylate

Systemtic Name: (2,4,6-tritert-butylphenyl) (2S)-spiro[2.3]hexane-2-carboxylate Openeye Name: (2,4,6-tritert-butylphenyl) (2S)-spiro[2.3]hexane-2-carboxylate CAS Name: (2S)-2-spiro[2.3]hexanecarboxylic acid (2,4,6-tritert-butylphenyl) ester IUPAC Name: (2,4,6-tritert-butylphenyl) (2S)-spiro[2.3]hexane-2-carboxylate Traditional Name: (2S)-spiro[2.3]hexane-2-carboxylic acid (2,4,6-tritert-butylphenyl) ester Formula: C25H38O2 MolecularWeight: 370.56802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)OC(=O)C2CC23CCC3)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)OC(=O)[C@H]2CC23CCC3)C(C)(C)C

InChI

InChI=1S/C25H38O2/c1-22(2,3)16-13-17(23(4,5)6)20(18(14-16)24(7,8)9)27-21(26)19-15-25(19)11-10-12-25/h13-14,19H,10-12,15H2,1-9H3/t19-/m1/s1