[(2R,3R,4S)-1,2-bis(4-methylphenoxy)-5-oxidanylidene-4-phenylmethoxy-pentan-3-yl] methanoate

Systemtic Name: [(2R,3R,4S)-1,2-bis(4-methylphenoxy)-5-oxidanylidene-4-phenylmethoxy-pentan-3-yl] methanoate Openeye Name: [(1R,2R)-1-[(1S)-1-benzyloxy-2-oxo-ethyl]-2,3-bis(4-methylphenoxy)propyl] formate CAS Name: formic acid [(2R,3R,4S)-1,2-bis(4-methylphenoxy)-5-oxo-4-phenylmethoxypentan-3-yl] ester IUPAC Name: [(2R,3R,4S)-1,2-bis(4-methylphenoxy)-5-oxo-4-phenylmethoxypentan-3-yl] formate Traditional Name: formic acid [(1R,2R)-1-[(1S)-1-benzoxy-2-keto-ethyl]-2,3-bis(4-methylphenoxy)propyl] ester Formula: C27H28O6 MolecularWeight: 448.50762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC(C(C(C=O)OCC2=CC=CC=C2)OC=O)OC3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)OC[C@H]([C@H]([C@@H](C=O)OCC2=CC=CC=C2)OC=O)OC3=CC=C(C=C3)C

InChI

InChI=1S/C27H28O6/c1-20-8-12-23(13-9-20)30-18-26(33-24-14-10-21(2)11-15-24)27(32-19-29)25(16-28)31-17-22-6-4-3-5-7-22/h3-16,19,25-27H,17-18H2,1-2H3/t25-,26-,27+/m1/s1