tert-butyl (E,5S,6S)-5,7,7-trimethyl-6-(phenylmethoxymethoxy)oct-2-enoate

Systemtic Name: tert-butyl (E,5S,6S)-5,7,7-trimethyl-6-(phenylmethoxymethoxy)oct-2-enoate Openeye Name: tert-butyl (E,5S,6S)-6-(benzyloxymethoxy)-5,7,7-trimethyl-oct-2-enoate CAS Name: (E,5S,6S)-5,7,7-trimethyl-6-(phenylmethoxymethoxy)-2-octenoic acid tert-butyl ester IUPAC Name: tert-butyl (E,5S,6S)-5,7,7-trimethyl-6-(phenylmethoxymethoxy)oct-2-enoate Traditional Name: (E,5S,6S)-6-(benzoxymethoxy)-5,7,7-trimethyl-oct-2-enoic acid tert-butyl ester Formula: C23H36O4 MolecularWeight: 376.52954

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=CC(=O)OC(C)(C)C)C(C(C)(C)C)OCOCC1=CC=CC=C1

Isomeric SMILES

C[C@@H](C/C=C/C(=O)OC(C)(C)C)[C@@H](C(C)(C)C)OCOCC1=CC=CC=C1

InChI

InChI=1S/C23H36O4/c1-18(12-11-15-20(24)27-23(5,6)7)21(22(2,3)4)26-17-25-16-19-13-9-8-10-14-19/h8-11,13-15,18,21H,12,16-17H2,1-7H3/b15-11+/t18-,21-/m0/s1