(3S,7R)-7-oxidanyl-3-phenylmethoxy-octanoic acid

Systemtic Name: (3S,7R)-7-oxidanyl-3-phenylmethoxy-octanoic acid Openeye Name: (3S,7R)-3-benzyloxy-7-hydroxy-octanoic acid CAS Name: (3S,7R)-7-hydroxy-3-phenylmethoxyoctanoic acid IUPAC Name: (3S,7R)-7-hydroxy-3-phenylmethoxyoctanoic acid Traditional Name: (3S,7R)-3-benzoxy-7-hydroxy-caprylic acid Formula: C15H22O4 MolecularWeight: 266.33278

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(CC(=O)O)OCC1=CC=CC=C1)O

Isomeric SMILES

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

InChI

InChI=1S/C15H22O4/c1-12(16)6-5-9-14(10-15(17)18)19-11-13-7-3-2-4-8-13/h2-4,7-8,12,14,16H,5-6,9-11H2,1H3,(H,17,18)/t12-,14+/m1/s1