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

Systemtic Name: 3-[5-(2,3,6-tricarboxyphenyl)pentyl]benzene-1,2,4-tricarboxylic acid Openeye Name: 3-[5-(2,3,6-tricarboxyphenyl)pentyl]benzene-1,2,4-tricarboxylic acid CAS Name: 3-[5-(2,3,6-tricarboxyphenyl)pentyl]benzene-1,2,4-tricarboxylic acid IUPAC Name: 3-[5-(2,3,6-tricarboxyphenyl)pentyl]benzene-1,2,4-tricarboxylic acid Traditional Name: 3-[5-(2,3,6-tricarboxyphenyl)pentyl]trimellitic acid Formula: C23H20O12 MolecularWeight: 488.3977

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1C(=O)O)CCCCCC2=C(C=CC(=C2C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1C(=O)O)CCCCCC2=C(C=CC(=C2C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C23H20O12/c24-18(25)12-6-8-14(20(28)29)16(22(32)33)10(12)4-2-1-3-5-11-13(19(26)27)7-9-15(21(30)31)17(11)23(34)35/h6-9H,1-5H2,(H,24,25)(H,26,27)(H,28,29)(H,30,31)(H,32,33)(H,34,35)