6-[10-(2,3,5-tricarboxyphenyl)decyl]benzene-1,2,4-tricarboxylic acid

Systemtic Name: 6-[10-(2,3,5-tricarboxyphenyl)decyl]benzene-1,2,4-tricarboxylic acid Openeye Name: 6-[10-(2,3,5-tricarboxyphenyl)decyl]benzene-1,2,4-tricarboxylic acid CAS Name: 6-[10-(2,3,5-tricarboxyphenyl)decyl]benzene-1,2,4-tricarboxylic acid IUPAC Name: 6-[10-(2,3,5-tricarboxyphenyl)decyl]benzene-1,2,4-tricarboxylic acid Traditional Name: 6-[10-(2,3,5-tricarboxyphenyl)decyl]trimellitic acid Formula: C28H30O12 MolecularWeight: 558.5306

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1C(=O)O)C(=O)O)CCCCCCCCCCC2=CC(=CC(=C2C(=O)O)C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=C(C=C(C(=C1C(=O)O)C(=O)O)CCCCCCCCCCC2=CC(=CC(=C2C(=O)O)C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C28H30O12/c29-23(30)17-11-15(21(27(37)38)19(13-17)25(33)34)9-7-5-3-1-2-4-6-8-10-16-12-18(24(31)32)14-20(26(35)36)22(16)28(39)40/h11-14H,1-10H2,(H,29,30)(H,31,32)(H,33,34)(H,35,36)(H,37,38)(H,39,40)