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4,5-diethyl-3-hexyl-phthalic acid

4,5-diethyl-3-hexyl-phthalic acid

Systemtic Name:4,5-diethyl-3-hexyl-phthalic acid
Openeye Name:4,5-diethyl-3-hexyl-phthalic acid
CAS Name:4,5-diethyl-3-hexylphthalic acid
IUPAC Name:4,5-diethyl-3-hexylphthalic acid
Traditional Name:4,5-diethyl-3-hexyl-phthalic acid
Formula: C18H26O4
MolecularWeight: 306.39664
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=CC(=C1CC)CC)C(=O)O)C(=O)O


Isomeric SMILES

CCCCCCC1=C(C(=CC(=C1CC)CC)C(=O)O)C(=O)O


InChI

InChI=1S/C18H26O4/c1-4-7-8-9-10-14-13(6-3)12(5-2)11-15(17(19)20)16(14)18(21)22/h11H,4-10H2,1-3H3,(H,19,20)(H,21,22)


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