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(2-hexan-3-ylphenyl) 4-[4-(1-octoxyethyl)phenyl]benzoate

(2-hexan-3-ylphenyl) 4-[4-(1-octoxyethyl)phenyl]benzoate

Systemtic Name:(2-hexan-3-ylphenyl) 4-[4-(1-octoxyethyl)phenyl]benzoate
Openeye Name:[2-(1-ethylbutyl)phenyl] 4-[4-(1-octoxyethyl)phenyl]benzoate
CAS Name:4-[4-(1-octoxyethyl)phenyl]benzoic acid (2-hexan-3-ylphenyl) ester
IUPAC Name:(2-hexan-3-ylphenyl) 4-[4-(1-octoxyethyl)phenyl]benzoate
Traditional Name:4-[4-(1-octoxyethyl)phenyl]benzoic acid [2-(1-ethylbutyl)phenyl] ester
Formula: C35H46O3
MolecularWeight: 514.73794
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3C(CC)CCC


Isomeric SMILES

CCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3C(CC)CCC


InChI

InChI=1S/C35H46O3/c1-5-8-9-10-11-14-26-37-27(4)29-18-20-30(21-19-29)31-22-24-32(25-23-31)35(36)38-34-17-13-12-16-33(34)28(7-3)15-6-2/h12-13,16-25,27-28H,5-11,14-15,26H2,1-4H3


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