8-phenylmethoxy-2-(6-phenylmethoxyhexyl)octanoic acid

Systemtic Name: 8-phenylmethoxy-2-(6-phenylmethoxyhexyl)octanoic acid Openeye Name: 8-benzyloxy-2-(6-benzyloxyhexyl)octanoic acid CAS Name: 8-phenylmethoxy-2-(6-phenylmethoxyhexyl)octanoic acid IUPAC Name: 8-phenylmethoxy-2-(6-phenylmethoxyhexyl)octanoic acid Traditional Name: 8-benzoxy-2-(6-benzoxyhexyl)caprylic acid Formula: C28H40O4 MolecularWeight: 440.6148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCCCCCC(CCCCCCOCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COCCCCCCC(CCCCCCOCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C28H40O4/c29-28(30)27(19-11-1-3-13-21-31-23-25-15-7-5-8-16-25)20-12-2-4-14-22-32-24-26-17-9-6-10-18-26/h5-10,15-18,27H,1-4,11-14,19-24H2,(H,29,30)