3-(7-methyloctyl)-4-pentyl-phthalic acid

Systemtic Name: 3-(7-methyloctyl)-4-pentyl-phthalic acid Openeye Name: 3-(7-methyloctyl)-4-pentyl-phthalic acid CAS Name: 3-(7-methyloctyl)-4-pentylphthalic acid IUPAC Name: 3-(7-methyloctyl)-4-pentylphthalic acid Traditional Name: 4-amyl-3-(7-methyloctyl)phthalic acid Formula: C22H34O4 MolecularWeight: 362.50296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(C=C1)C(=O)O)C(=O)O)CCCCCCC(C)C

Isomeric SMILES

CCCCCC1=C(C(=C(C=C1)C(=O)O)C(=O)O)CCCCCCC(C)C

InChI

InChI=1S/C22H34O4/c1-4-5-8-12-17-14-15-19(21(23)24)20(22(25)26)18(17)13-10-7-6-9-11-16(2)3/h14-16H,4-13H2,1-3H3,(H,23,24)(H,25,26)