2,4,5-tris(undecoxycarbonyl)benzoic acid

Systemtic Name: 2,4,5-tris(undecoxycarbonyl)benzoic acid Openeye Name: 2,4,5-tris(undecoxycarbonyl)benzoic acid CAS Name: 2,4,5-tris[oxo(undecoxy)methyl]benzoic acid IUPAC Name: 2,4,5-tris(undecoxycarbonyl)benzoic acid Traditional Name: 2,4,5-tris(undecoxycarbonyl)benzoic acid Formula: C43H72O8 MolecularWeight: 717.02698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC(=O)C1=CC(=C(C=C1C(=O)O)C(=O)OCCCCCCCCCCC)C(=O)OCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCOC(=O)C1=CC(=C(C=C1C(=O)O)C(=O)OCCCCCCCCCCC)C(=O)OCCCCCCCCCCC

InChI

InChI=1S/C43H72O8/c1-4-7-10-13-16-19-22-25-28-31-49-41(46)37-35-39(43(48)51-33-30-27-24-21-18-15-12-9-6-3)38(34-36(37)40(44)45)42(47)50-32-29-26-23-20-17-14-11-8-5-2/h34-35H,4-33H2,1-3H3,(H,44,45)