8-(5-octyl-2-phenyl-1,3-dioxolan-4-yl)octanoic acid

Systemtic Name: 8-(5-octyl-2-phenyl-1,3-dioxolan-4-yl)octanoic acid Openeye Name: 8-(5-octyl-2-phenyl-1,3-dioxolan-4-yl)octanoic acid CAS Name: 8-(5-octyl-2-phenyl-1,3-dioxolan-4-yl)octanoic acid IUPAC Name: 8-(5-octyl-2-phenyl-1,3-dioxolan-4-yl)octanoic acid Traditional Name: 8-(5-octyl-2-phenyl-1,3-dioxolan-4-yl)caprylic acid Formula: C25H40O4 MolecularWeight: 404.5827

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1C(OC(O1)C2=CC=CC=C2)CCCCCCCC(=O)O

Isomeric SMILES

CCCCCCCCC1C(OC(O1)C2=CC=CC=C2)CCCCCCCC(=O)O

InChI

InChI=1S/C25H40O4/c1-2-3-4-5-7-13-18-22-23(19-14-8-6-9-15-20-24(26)27)29-25(28-22)21-16-11-10-12-17-21/h10-12,16-17,22-23,25H,2-9,13-15,18-20H2,1H3,(H,26,27)