3,4-bis(3-methylhexyl)phthalic acid

Systemtic Name: 3,4-bis(3-methylhexyl)phthalic acid Openeye Name: 3,4-bis(3-methylhexyl)phthalic acid CAS Name: 3,4-bis(3-methylhexyl)phthalic acid IUPAC Name: 3,4-bis(3-methylhexyl)phthalic acid Traditional Name: 3,4-bis(3-methylhexyl)phthalic acid Formula: C22H34O4 MolecularWeight: 362.50296

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)CCC1=C(C(=C(C=C1)C(=O)O)C(=O)O)CCC(C)CCC

Isomeric SMILES

CCCC(C)CCC1=C(C(=C(C=C1)C(=O)O)C(=O)O)CCC(C)CCC

InChI

InChI=1S/C22H34O4/c1-5-7-15(3)9-11-17-12-14-19(21(23)24)20(22(25)26)18(17)13-10-16(4)8-6-2/h12,14-16H,5-11,13H2,1-4H3,(H,23,24)(H,25,26)