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

Systemtic Name: 4-hexyl-3-(7-methyloctyl)phthalic acid Openeye Name: 4-hexyl-3-(7-methyloctyl)phthalic acid CAS Name: 4-hexyl-3-(7-methyloctyl)phthalic acid IUPAC Name: 4-hexyl-3-(7-methyloctyl)phthalic acid Traditional Name: 4-hexyl-3-(7-methyloctyl)phthalic acid Formula: C23H36O4 MolecularWeight: 376.52954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=C(C=C1)C(=O)O)C(=O)O)CCCCCCC(C)C

Isomeric SMILES

CCCCCCC1=C(C(=C(C=C1)C(=O)O)C(=O)O)CCCCCCC(C)C

InChI

InChI=1S/C23H36O4/c1-4-5-6-10-13-18-15-16-20(22(24)25)21(23(26)27)19(18)14-11-8-7-9-12-17(2)3/h15-17H,4-14H2,1-3H3,(H,24,25)(H,26,27)