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

Systemtic Name: 2,4-dihexylbenzene-1,3-dicarboxylic acid Openeye Name: 2,4-dihexylbenzene-1,3-dicarboxylic acid CAS Name: 2,4-dihexylbenzene-1,3-dicarboxylic acid IUPAC Name: 2,4-dihexylbenzene-1,3-dicarboxylic acid Traditional Name: 2,4-dihexylisophthalic acid Formula: C20H30O4 MolecularWeight: 334.4498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=C(C=C1)C(=O)O)CCCCCC)C(=O)O

Isomeric SMILES

CCCCCCC1=C(C(=C(C=C1)C(=O)O)CCCCCC)C(=O)O

InChI

InChI=1S/C20H30O4/c1-3-5-7-9-11-15-13-14-17(19(21)22)16(18(15)20(23)24)12-10-8-6-4-2/h13-14H,3-12H2,1-2H3,(H,21,22)(H,23,24)