3-(3-methoxy-2-phenylmethoxy-phenyl)octanoic acid

Systemtic Name: 3-(3-methoxy-2-phenylmethoxy-phenyl)octanoic acid Openeye Name: 3-(2-benzyloxy-3-methoxy-phenyl)octanoic acid CAS Name: 3-(3-methoxy-2-phenylmethoxyphenyl)octanoic acid IUPAC Name: 3-(3-methoxy-2-phenylmethoxyphenyl)octanoic acid Traditional Name: 3-(2-benzoxy-3-methoxy-phenyl)caprylic acid Formula: C22H28O4 MolecularWeight: 356.45532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28O4/c1-3-4-6-12-18(15-21(23)24)19-13-9-14-20(25-2)22(19)26-16-17-10-7-5-8-11-17/h5,7-11,13-14,18H,3-4,6,12,15-16H2,1-2H3,(H,23,24)