2-(2-ethanoyl-4-phenylmethoxy-phenyl)-8-oxidanylidene-octanoic acid

Systemtic Name: 2-(2-ethanoyl-4-phenylmethoxy-phenyl)-8-oxidanylidene-octanoic acid Openeye Name: 2-(2-acetyl-4-benzyloxy-phenyl)-8-oxo-octanoic acid CAS Name: 2-(2-acetyl-4-phenylmethoxyphenyl)-8-oxooctanoic acid IUPAC Name: 2-(2-acetyl-4-phenylmethoxyphenyl)-8-oxooctanoic acid Traditional Name: 2-(2-acetyl-4-benzoxy-phenyl)-8-keto-caprylic acid Formula: C23H26O5 MolecularWeight: 382.44954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26O5/c1-17(25)22-15-19(28-16-18-9-5-4-6-10-18)12-13-20(22)21(23(26)27)11-7-2-3-8-14-24/h4-6,9-10,12-15,21H,2-3,7-8,11,16H2,1H3,(H,26,27)