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2,4,6-tris(2-ethylhexyl)benzene-1,3,5-tricarboxylate

2,4,6-tris(2-ethylhexyl)benzene-1,3,5-tricarboxylate

Systemtic Name:2,4,6-tris(2-ethylhexyl)benzene-1,3,5-tricarboxylate
Openeye Name:2,4,6-tris(2-ethylhexyl)benzene-1,3,5-tricarboxylate
CAS Name:2,4,6-tris(2-ethylhexyl)benzene-1,3,5-tricarboxylate
IUPAC Name:2,4,6-tris(2-ethylhexyl)benzene-1,3,5-tricarboxylate
Traditional Name:2,4,6-tris(2-ethylhexyl)benzene-1,3,5-tricarboxylate
Formula: C33H51O6-3
MolecularWeight: 543.75444
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC1=C(C(=C(C(=C1C(=O)[O-])CC(CC)CCCC)C(=O)[O-])CC(CC)CCCC)C(=O)[O-]


Isomeric SMILES

CCCCC(CC)CC1=C(C(=C(C(=C1C(=O)[O-])CC(CC)CCCC)C(=O)[O-])CC(CC)CCCC)C(=O)[O-]


InChI

InChI=1S/C33H54O6/c1-7-13-16-22(10-4)19-25-28(31(34)35)26(20-23(11-5)17-14-8-2)30(33(38)39)27(29(25)32(36)37)21-24(12-6)18-15-9-3/h22-24H,7-21H2,1-6H3,(H,34,35)(H,36,37)(H,38,39)/p-3


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