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[4-(5-pentylpyrimidin-2-yl)phenyl] (E)-7-cyclohexylhept-2-enoate

Systemtic Name:	[4-(5-pentylpyrimidin-2-yl)phenyl] (E)-7-cyclohexylhept-2-enoate
Openeye Name:	[4-(5-pentylpyrimidin-2-yl)phenyl] (E)-7-cyclohexylhept-2-enoate
CAS Name:	(E)-7-cyclohexyl-2-heptenoic acid [4-(5-pentyl-2-pyrimidinyl)phenyl] ester
IUPAC Name:	[4-(5-pentylpyrimidin-2-yl)phenyl] (E)-7-cyclohexylhept-2-enoate
Traditional Name:	(E)-7-cyclohexylhept-2-enoic acid [4-(5-amylpyrimidin-2-yl)phenyl] ester
Formula:	C₂₈H₃₈N₂O₂
MolecularWeight:	434.61352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C=CCCCCC3CCCCC3

Isomeric SMILES

CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)/C=C/CCCCC3CCCCC3

InChI

InChI=1S/C28H38N2O2/c1-2-3-7-15-24-21-29-28(30-22-24)25-17-19-26(20-18-25)32-27(31)16-11-5-4-8-12-23-13-9-6-10-14-23/h11,16-23H,2-10,12-15H2,1H3/b16-11+

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