methyl (E)-3-[(5S,6R)-9-oxidanylidene-1,6-bis(phenylmethoxy)decan-5-yl]oxyprop-2-enoate

Systemtic Name: methyl (E)-3-[(5S,6R)-9-oxidanylidene-1,6-bis(phenylmethoxy)decan-5-yl]oxyprop-2-enoate Openeye Name: methyl (E)-3-[(1S,2R)-2-benzyloxy-1-(4-benzyloxybutyl)-5-oxo-hexoxy]prop-2-enoate CAS Name: (E)-3-[(5S,6R)-9-oxo-1,6-bis(phenylmethoxy)decan-5-yl]oxy-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[(5S,6R)-9-oxo-1,6-bis(phenylmethoxy)decan-5-yl]oxyprop-2-enoate Traditional Name: (E)-3-[(1S,2R)-2-benzoxy-1-(4-benzoxybutyl)-5-keto-hexoxy]acrylic acid methyl ester Formula: C28H36O6 MolecularWeight: 468.58184

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(C(CCCCOCC1=CC=CC=C1)OC=CC(=O)OC)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)CC[C@H]([C@H](CCCCOCC1=CC=CC=C1)O/C=C/C(=O)OC)OCC2=CC=CC=C2

InChI

InChI=1S/C28H36O6/c1-23(29)16-17-27(34-22-25-13-7-4-8-14-25)26(33-20-18-28(30)31-2)15-9-10-19-32-21-24-11-5-3-6-12-24/h3-8,11-14,18,20,26-27H,9-10,15-17,19,21-22H2,1-2H3/b20-18+/t26-,27+/m0/s1