8-(5,6-diphenylpyridin-2-yl)oxyoctanoic acid

Systemtic Name: 8-(5,6-diphenylpyridin-2-yl)oxyoctanoic acid Openeye Name: 8-[(5,6-diphenyl-2-pyridyl)oxy]octanoic acid CAS Name: 8-[(5,6-diphenyl-2-pyridinyl)oxy]octanoic acid IUPAC Name: 8-(5,6-diphenylpyridin-2-yl)oxyoctanoic acid Traditional Name: 8-[(5,6-diphenyl-2-pyridyl)oxy]caprylic acid Formula: C25H27NO3 MolecularWeight: 389.48678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=C(C=C2)OCCCCCCCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=C(C=C2)OCCCCCCCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C25H27NO3/c27-24(28)16-10-2-1-3-11-19-29-23-18-17-22(20-12-6-4-7-13-20)25(26-23)21-14-8-5-9-15-21/h4-9,12-15,17-18H,1-3,10-11,16,19H2,(H,27,28)