2,4-diheptylbenzene-1,3-dicarboxylic acid

Systemtic Name: 2,4-diheptylbenzene-1,3-dicarboxylic acid Openeye Name: 2,4-diheptylbenzene-1,3-dicarboxylic acid CAS Name: 2,4-diheptylbenzene-1,3-dicarboxylic acid IUPAC Name: 2,4-diheptylbenzene-1,3-dicarboxylic acid Traditional Name: 2,4-diheptylisophthalic acid Formula: C22H34O4 MolecularWeight: 362.50296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(C(=C(C=C1)C(=O)O)CCCCCCC)C(=O)O

Isomeric SMILES

CCCCCCCC1=C(C(=C(C=C1)C(=O)O)CCCCCCC)C(=O)O

InChI

InChI=1S/C22H34O4/c1-3-5-7-9-11-13-17-15-16-19(21(23)24)18(20(17)22(25)26)14-12-10-8-6-4-2/h15-16H,3-14H2,1-2H3,(H,23,24)(H,25,26)