[(3R,4S,5R)-4-methoxy-2-methyl-7-oxidanylidene-5-phenylmethoxy-heptan-3-yl] benzoate

Systemtic Name: [(3R,4S,5R)-4-methoxy-2-methyl-7-oxidanylidene-5-phenylmethoxy-heptan-3-yl] benzoate Openeye Name: [(1R,2S,3R)-3-benzyloxy-1-isopropyl-2-methoxy-5-oxo-pentyl] benzoate CAS Name: benzoic acid [(3R,4S,5R)-4-methoxy-2-methyl-7-oxo-5-phenylmethoxyheptan-3-yl] ester IUPAC Name: [(3R,4S,5R)-4-methoxy-2-methyl-7-oxo-5-phenylmethoxyheptan-3-yl] benzoate Traditional Name: benzoic acid [(1R,2S,3R)-3-benzoxy-1-isopropyl-5-keto-2-methoxy-pentyl] ester Formula: C23H28O5 MolecularWeight: 384.46542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C(CC=O)OCC1=CC=CC=C1)OC)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)[C@H]([C@H]([C@@H](CC=O)OCC1=CC=CC=C1)OC)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C23H28O5/c1-17(2)21(28-23(25)19-12-8-5-9-13-19)22(26-3)20(14-15-24)27-16-18-10-6-4-7-11-18/h4-13,15,17,20-22H,14,16H2,1-3H3/t20-,21-,22+/m1/s1