methyl (E,4R,5S,6R)-4-acetyloxy-5-methyl-6,7-bis(phenylmethoxy)hept-2-enoate

Systemtic Name: methyl (E,4R,5S,6R)-4-acetyloxy-5-methyl-6,7-bis(phenylmethoxy)hept-2-enoate Openeye Name: methyl (E,4R,5S,6R)-4-acetoxy-6,7-dibenzyloxy-5-methyl-hept-2-enoate CAS Name: (E,4R,5S,6R)-4-acetyloxy-5-methyl-6,7-bis(phenylmethoxy)-2-heptenoic acid methyl ester IUPAC Name: methyl (E,4R,5S,6R)-4-acetyloxy-5-methyl-6,7-bis(phenylmethoxy)hept-2-enoate Traditional Name: (E,4R,5S,6R)-4-acetoxy-6,7-dibenzoxy-5-methyl-hept-2-enoic acid methyl ester Formula: C25H30O6 MolecularWeight: 426.5021

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H30O6/c1-19(23(31-20(2)26)14-15-25(27)28-3)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