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[4-[4-(1-hexoxyethyl)phenyl]phenyl] 4-pentadecylbenzoate

Systemtic Name:	[4-[4-(1-hexoxyethyl)phenyl]phenyl] 4-pentadecylbenzoate
Openeye Name:	[4-[4-(1-hexoxyethyl)phenyl]phenyl] 4-pentadecylbenzoate
CAS Name:	4-pentadecylbenzoic acid [4-[4-(1-hexoxyethyl)phenyl]phenyl] ester
IUPAC Name:	[4-[4-(1-hexoxyethyl)phenyl]phenyl] 4-pentadecylbenzoate
Traditional Name:	4-pentadecylbenzoic acid [4-[4-(1-hexoxyethyl)phenyl]phenyl] ester
Formula:	C₄₂H₆₀O₃
MolecularWeight:	612.924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C(C)OCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C(C)OCCCCCC

InChI

InChI=1S/C42H60O3/c1-4-6-8-10-11-12-13-14-15-16-17-18-19-21-36-22-24-40(25-23-36)42(43)45-41-32-30-39(31-33-41)38-28-26-37(27-29-38)35(3)44-34-20-9-7-5-2/h22-33,35H,4-21,34H2,1-3H3

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