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

Systemtic Name: 2,4,5-tris(nonoxycarbonyl)benzoic acid Openeye Name: 2,4,5-tris(nonoxycarbonyl)benzoic acid CAS Name: 2,4,5-tris[nonoxy(oxo)methyl]benzoic acid IUPAC Name: 2,4,5-tris(nonoxycarbonyl)benzoic acid Traditional Name: 2,4,5-tris(nonoxycarbonyl)benzoic acid Formula: C37H60O8 MolecularWeight: 632.8675

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC(=O)C1=CC(=C(C=C1C(=O)O)C(=O)OCCCCCCCCC)C(=O)OCCCCCCCCC

Isomeric SMILES

CCCCCCCCCOC(=O)C1=CC(=C(C=C1C(=O)O)C(=O)OCCCCCCCCC)C(=O)OCCCCCCCCC

InChI

InChI=1S/C37H60O8/c1-4-7-10-13-16-19-22-25-43-35(40)31-29-33(37(42)45-27-24-21-18-15-12-9-6-3)32(28-30(31)34(38)39)36(41)44-26-23-20-17-14-11-8-5-2/h28-29H,4-27H2,1-3H3,(H,38,39)