tert-butyl (E,5S,7S,8S)-5,7-dimethyl-8-phenyl-8-(phenylmethoxymethoxy)oct-2-enoate

Systemtic Name: tert-butyl (E,5S,7S,8S)-5,7-dimethyl-8-phenyl-8-(phenylmethoxymethoxy)oct-2-enoate Openeye Name: tert-butyl (E,5S,7S,8S)-8-(benzyloxymethoxy)-5,7-dimethyl-8-phenyl-oct-2-enoate CAS Name: (E,5S,7S,8S)-5,7-dimethyl-8-phenyl-8-(phenylmethoxymethoxy)-2-octenoic acid tert-butyl ester IUPAC Name: tert-butyl (E,5S,7S,8S)-5,7-dimethyl-8-phenyl-8-(phenylmethoxymethoxy)oct-2-enoate Traditional Name: (E,5S,7S,8S)-8-(benzoxymethoxy)-5,7-dimethyl-8-phenyl-oct-2-enoic acid tert-butyl ester Formula: C28H38O4 MolecularWeight: 438.59892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H38O4/c1-22(13-12-18-26(29)32-28(3,4)5)19-23(2)27(25-16-10-7-11-17-25)31-21-30-20-24-14-8-6-9-15-24/h6-12,14-18,22-23,27H,13,19-21H2,1-5H3/b18-12+/t22-,23-,27-/m0/s1