2-[4-[(1E)-cycloocten-1-yl]phenoxy]octanoic acid

Systemtic Name: 2-[4-[(1E)-cycloocten-1-yl]phenoxy]octanoic acid Openeye Name: 2-[4-[(1E)-cycloocten-1-yl]phenoxy]octanoic acid CAS Name: 2-[4-[(1E)-1-cyclooctenyl]phenoxy]octanoic acid IUPAC Name: 2-[4-[(1E)-cycloocten-1-yl]phenoxy]octanoic acid Traditional Name: 2-[4-[(1E)-cycloocten-1-yl]phenoxy]caprylic acid Formula: C22H32O3 MolecularWeight: 344.48768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)O)OC1=CC=C(C=C1)C2=CCCCCCC2

Isomeric SMILES

CCCCCCC(C(=O)O)OC1=CC=C(C=C1)/C/2=C/CCCCCC2

InChI

InChI=1S/C22H32O3/c1-2-3-4-10-13-21(22(23)24)25-20-16-14-19(15-17-20)18-11-8-6-5-7-9-12-18/h11,14-17,21H,2-10,12-13H2,1H3,(H,23,24)/b18-11+