tert-butyl (3R,5S,6S)-3,5-dimethyl-6-phenyl-6-(phenylmethoxymethoxy)hexanoate

Systemtic Name: tert-butyl (3R,5S,6S)-3,5-dimethyl-6-phenyl-6-(phenylmethoxymethoxy)hexanoate Openeye Name: tert-butyl (3R,5S,6S)-6-(benzyloxymethoxy)-3,5-dimethyl-6-phenyl-hexanoate CAS Name: (3R,5S,6S)-3,5-dimethyl-6-phenyl-6-(phenylmethoxymethoxy)hexanoic acid tert-butyl ester IUPAC Name: tert-butyl (3R,5S,6S)-3,5-dimethyl-6-phenyl-6-(phenylmethoxymethoxy)hexanoate Traditional Name: (3R,5S,6S)-6-(benzoxymethoxy)-3,5-dimethyl-6-phenyl-hexanoic acid tert-butyl ester Formula: C26H36O4 MolecularWeight: 412.56164

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)C(C1=CC=CC=C1)OCOCC2=CC=CC=C2)CC(=O)OC(C)(C)C

Isomeric SMILES

C[C@H](C[C@H](C)[C@@H](C1=CC=CC=C1)OCOCC2=CC=CC=C2)CC(=O)OC(C)(C)C

InChI

InChI=1S/C26H36O4/c1-20(17-24(27)30-26(3,4)5)16-21(2)25(23-14-10-7-11-15-23)29-19-28-18-22-12-8-6-9-13-22/h6-15,20-21,25H,16-19H2,1-5H3/t20-,21+,25+/m1/s1