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(4-heptylphenyl) 4-(4-heptan-2-ylcyclohexen-1-yl)benzoate

(4-heptylphenyl) 4-(4-heptan-2-ylcyclohexen-1-yl)benzoate

Systemtic Name:(4-heptylphenyl) 4-(4-heptan-2-ylcyclohexen-1-yl)benzoate
Openeye Name:(4-heptylphenyl) 4-[4-(1-methylhexyl)cyclohexen-1-yl]benzoate
CAS Name:4-(4-heptan-2-yl-1-cyclohexenyl)benzoic acid (4-heptylphenyl) ester
IUPAC Name:(4-heptylphenyl) 4-(4-heptan-2-ylcyclohexen-1-yl)benzoate
Traditional Name:4-[4-(1-methylhexyl)cyclohexen-1-yl]benzoic acid (4-heptylphenyl) ester
Formula: C33H46O2
MolecularWeight: 474.71714
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CCC(CC3)C(C)CCCCC


Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CCC(CC3)C(C)CCCCC


InChI

InChI=1S/C33H46O2/c1-4-6-8-9-11-13-27-14-24-32(25-15-27)35-33(34)31-22-20-30(21-23-31)29-18-16-28(17-19-29)26(3)12-10-7-5-2/h14-15,18,20-26,28H,4-13,16-17,19H2,1-3H3


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