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[4-[4-(1-octoxyethyl)phenyl]phenyl] 4-hexylbenzoate

Systemtic Name:	[4-[4-(1-octoxyethyl)phenyl]phenyl] 4-hexylbenzoate
Openeye Name:	[4-[4-(1-octoxyethyl)phenyl]phenyl] 4-hexylbenzoate
CAS Name:	4-hexylbenzoic acid [4-[4-(1-octoxyethyl)phenyl]phenyl] ester
IUPAC Name:	[4-[4-(1-octoxyethyl)phenyl]phenyl] 4-hexylbenzoate
Traditional Name:	4-hexylbenzoic acid [4-[4-(1-octoxyethyl)phenyl]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)OC(=O)C3=CC=C(C=C3)CCCCCC

Isomeric SMILES

CCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCCCC

InChI

InChI=1S/C35H46O3/c1-4-6-8-10-11-13-27-37-28(3)30-19-21-31(22-20-30)32-23-25-34(26-24-32)38-35(36)33-17-15-29(16-18-33)14-12-9-7-5-2/h15-26,28H,4-14,27H2,1-3H3

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