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[4-[4-(4-heptylcyclohexen-1-yl)phenyl]phenyl] octanoate

Systemtic Name:	[4-[4-(4-heptylcyclohexen-1-yl)phenyl]phenyl] octanoate
Openeye Name:	[4-[4-(4-heptylcyclohexen-1-yl)phenyl]phenyl] octanoate
CAS Name:	octanoic acid [4-[4-(4-heptyl-1-cyclohexenyl)phenyl]phenyl] ester
IUPAC Name:	[4-[4-(4-heptylcyclohexen-1-yl)phenyl]phenyl] octanoate
Traditional Name:	caprylic acid [4-[4-(4-heptylcyclohexen-1-yl)phenyl]phenyl] ester
Formula:	C₃₃H₄₆O₂
MolecularWeight:	474.71714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(=CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)CCCCCCC

Isomeric SMILES

CCCCCCCC1CCC(=CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)CCCCCCC

InChI

InChI=1S/C33H46O2/c1-3-5-7-9-11-13-27-15-17-28(18-16-27)29-19-21-30(22-20-29)31-23-25-32(26-24-31)35-33(34)14-12-10-8-6-4-2/h17,19-27H,3-16,18H2,1-2H3

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