2-butyl-8-(3-octyloxiran-2-yl)octanoic acid

Systemtic Name: 2-butyl-8-(3-octyloxiran-2-yl)octanoic acid Openeye Name: 2-butyl-8-(3-octyloxiran-2-yl)octanoic acid CAS Name: 2-butyl-8-(3-octyl-2-oxiranyl)octanoic acid IUPAC Name: 2-butyl-8-(3-octyloxiran-2-yl)octanoic acid Traditional Name: 2-butyl-8-(3-octyloxiran-2-yl)caprylic acid Formula: C22H42O3 MolecularWeight: 354.56708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1C(O1)CCCCCCC(CCCC)C(=O)O

Isomeric SMILES

CCCCCCCCC1C(O1)CCCCCCC(CCCC)C(=O)O

InChI

InChI=1S/C22H42O3/c1-3-5-7-8-9-13-17-20-21(25-20)18-14-11-10-12-16-19(22(23)24)15-6-4-2/h19-21H,3-18H2,1-2H3,(H,23,24)