2-heptoxy-5,6-bis(heptylperoxy)-3-propyl-benzoic acid

Systemtic Name: 2-heptoxy-5,6-bis(heptylperoxy)-3-propyl-benzoic acid Openeye Name: 2-heptoxy-5,6-bis(heptylperoxy)-3-propyl-benzoic acid CAS Name: 2-heptoxy-5,6-bis(heptyldioxy)-3-propylbenzoic acid IUPAC Name: 2-heptoxy-5,6-bis(heptylperoxy)-3-propylbenzoic acid Traditional Name: 2-heptoxy-5,6-bis(heptylperoxy)-3-propyl-benzoic acid Formula: C31H54O7 MolecularWeight: 538.75626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C(=C(C=C1CCC)OOCCCCCCC)OOCCCCCCC)C(=O)O

Isomeric SMILES

CCCCCCCOC1=C(C(=C(C=C1CCC)OOCCCCCCC)OOCCCCCCC)C(=O)O

InChI

InChI=1S/C31H54O7/c1-5-9-12-15-18-22-34-29-26(21-8-4)25-27(37-35-23-19-16-13-10-6-2)30(28(29)31(32)33)38-36-24-20-17-14-11-7-3/h25H,5-24H2,1-4H3,(H,32,33)