(phenylmethyl) (2S,3R)-2-methyl-3-oxidanyl-7-phenylmethoxy-heptanoate

Systemtic Name: (phenylmethyl) (2S,3R)-2-methyl-3-oxidanyl-7-phenylmethoxy-heptanoate Openeye Name: benzyl (2S,3R)-7-benzyloxy-3-hydroxy-2-methyl-heptanoate CAS Name: (2S,3R)-3-hydroxy-2-methyl-7-phenylmethoxyheptanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,3R)-3-hydroxy-2-methyl-7-phenylmethoxyheptanoate Traditional Name: (2S,3R)-7-benzoxy-3-hydroxy-2-methyl-enanthic acid benzyl ester Formula: C22H28O4 MolecularWeight: 356.45532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28O4/c1-18(22(24)26-17-20-12-6-3-7-13-20)21(23)14-8-9-15-25-16-19-10-4-2-5-11-19/h2-7,10-13,18,21,23H,8-9,14-17H2,1H3/t18-,21+/m0/s1