tert-butyl (2R)-2-[(2S)-2-(hydroxymethyl)-3-(4-phenylphenyl)propyl]hexanoate

Systemtic Name: tert-butyl (2R)-2-[(2S)-2-(hydroxymethyl)-3-(4-phenylphenyl)propyl]hexanoate Openeye Name: tert-butyl (2R)-2-[(2S)-2-(hydroxymethyl)-3-(4-phenylphenyl)propyl]hexanoate CAS Name: (2R)-2-[(2S)-2-(hydroxymethyl)-3-(4-phenylphenyl)propyl]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-[(2S)-2-(hydroxymethyl)-3-(4-phenylphenyl)propyl]hexanoate Traditional Name: (2R)-2-[(2S)-2-methylol-3-(4-phenylphenyl)propyl]hexanoic acid tert-butyl ester Formula: C26H36O3 MolecularWeight: 396.56224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(CC1=CC=C(C=C1)C2=CC=CC=C2)CO)C(=O)OC(C)(C)C

Isomeric SMILES

CCCC[C@H](C[C@@H](CC1=CC=C(C=C1)C2=CC=CC=C2)CO)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H36O3/c1-5-6-10-24(25(28)29-26(2,3)4)18-21(19-27)17-20-13-15-23(16-14-20)22-11-8-7-9-12-22/h7-9,11-16,21,24,27H,5-6,10,17-19H2,1-4H3/t21-,24-/m1/s1