2-nonoxy-5,6-bis(nonylperoxy)-3-pentyl-benzoic acid

Systemtic Name: 2-nonoxy-5,6-bis(nonylperoxy)-3-pentyl-benzoic acid Openeye Name: 2-nonoxy-5,6-bis(nonylperoxy)-3-pentyl-benzoic acid CAS Name: 2-nonoxy-5,6-bis(nonyldioxy)-3-pentylbenzoic acid IUPAC Name: 2-nonoxy-5,6-bis(nonylperoxy)-3-pentylbenzoic acid Traditional Name: 3-amyl-2-nonoxy-5,6-bis(nonylperoxy)benzoic acid Formula: C39H70O7 MolecularWeight: 650.9689

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=C(C(=C(C=C1CCCCC)OOCCCCCCCCC)OOCCCCCCCCC)C(=O)O

Isomeric SMILES

CCCCCCCCCOC1=C(C(=C(C=C1CCCCC)OOCCCCCCCCC)OOCCCCCCCCC)C(=O)O

InChI

InChI=1S/C39H70O7/c1-5-9-13-16-19-22-26-30-42-37-34(29-25-12-8-4)33-35(45-43-31-27-23-20-17-14-10-6-2)38(36(37)39(40)41)46-44-32-28-24-21-18-15-11-7-3/h33H,5-32H2,1-4H3,(H,40,41)