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(2-octan-4-ylphenyl) 4-[4-(1-butoxyethyl)phenyl]benzoate

(2-octan-4-ylphenyl) 4-[4-(1-butoxyethyl)phenyl]benzoate

Systemtic Name:(2-octan-4-ylphenyl) 4-[4-(1-butoxyethyl)phenyl]benzoate
Openeye Name:[2-(1-propylpentyl)phenyl] 4-[4-(1-butoxyethyl)phenyl]benzoate
CAS Name:4-[4-(1-butoxyethyl)phenyl]benzoic acid (2-octan-4-ylphenyl) ester
IUPAC Name:(2-octan-4-ylphenyl) 4-[4-(1-butoxyethyl)phenyl]benzoate
Traditional Name:4-[4-(1-butoxyethyl)phenyl]benzoic acid [2-(1-propylpentyl)phenyl] ester
Formula: C33H42O3
MolecularWeight: 486.68478
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC)C1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(C)OCCCC


Isomeric SMILES

CCCCC(CCC)C1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(C)OCCCC


InChI

InChI=1S/C33H42O3/c1-5-8-13-29(12-7-3)31-14-10-11-15-32(31)36-33(34)30-22-20-28(21-23-30)27-18-16-26(17-19-27)25(4)35-24-9-6-2/h10-11,14-23,25,29H,5-9,12-13,24H2,1-4H3


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