methyl (E,2S,5S,6R)-2-acetyloxy-5-methyl-6,7-bis(phenylmethoxy)hept-3-enoate

Systemtic Name: methyl (E,2S,5S,6R)-2-acetyloxy-5-methyl-6,7-bis(phenylmethoxy)hept-3-enoate Openeye Name: methyl (E,2S,5S,6R)-2-acetoxy-6,7-dibenzyloxy-5-methyl-hept-3-enoate CAS Name: (E,2S,5S,6R)-2-acetyloxy-5-methyl-6,7-bis(phenylmethoxy)-3-heptenoic acid methyl ester IUPAC Name: methyl (E,2S,5S,6R)-2-acetyloxy-5-methyl-6,7-bis(phenylmethoxy)hept-3-enoate Traditional Name: (E,2S,5S,6R)-2-acetoxy-6,7-dibenzoxy-5-methyl-hept-3-enoic acid methyl ester Formula: C25H30O6 MolecularWeight: 426.5021

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=CC(C(=O)OC)OC(=O)C)C(COCC1=CC=CC=C1)OCC2=CC=CC=C2

Isomeric SMILES

C[C@@H](/C=C/[C@@H](C(=O)OC)OC(=O)C)[C@H](COCC1=CC=CC=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C25H30O6/c1-19(14-15-23(25(27)28-3)31-20(2)26)24(30-17-22-12-8-5-9-13-22)18-29-16-21-10-6-4-7-11-21/h4-15,19,23-24H,16-18H2,1-3H3/b15-14+/t19-,23-,24-/m0/s1