5-oxidanylidene-8-phenylmethoxy-octanoic acid

Systemtic Name: 5-oxidanylidene-8-phenylmethoxy-octanoic acid Openeye Name: 8-benzyloxy-5-oxo-octanoic acid CAS Name: 5-oxo-8-phenylmethoxyoctanoic acid IUPAC Name: 5-oxo-8-phenylmethoxyoctanoic acid Traditional Name: 8-benzoxy-5-keto-caprylic acid Formula: C15H20O4 MolecularWeight: 264.3169

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCCC(=O)CCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COCCCC(=O)CCCC(=O)O

InChI

InChI=1S/C15H20O4/c16-14(8-4-10-15(17)18)9-5-11-19-12-13-6-2-1-3-7-13/h1-3,6-7H,4-5,8-12H2,(H,17,18)