[4-[5-(5-cyclopentylpentoxy)pyrimidin-2-yl]phenyl] 4-hexylcyclohexane-1-carboxylate

Systemtic Name: [4-[5-(5-cyclopentylpentoxy)pyrimidin-2-yl]phenyl] 4-hexylcyclohexane-1-carboxylate Openeye Name: [4-[5-(5-cyclopentylpentoxy)pyrimidin-2-yl]phenyl] 4-hexylcyclohexanecarboxylate CAS Name: 4-hexyl-1-cyclohexanecarboxylic acid [4-[5-(5-cyclopentylpentoxy)-2-pyrimidinyl]phenyl] ester IUPAC Name: [4-[5-(5-cyclopentylpentoxy)pyrimidin-2-yl]phenyl] 4-hexylcyclohexane-1-carboxylate Traditional Name: 4-hexylcyclohexanecarboxylic acid [4-[5-(5-cyclopentylpentoxy)pyrimidin-2-yl]phenyl] ester Formula: C33H48N2O3 MolecularWeight: 520.74582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)C3=NC=C(C=N3)OCCCCCC4CCCC4

Isomeric SMILES

CCCCCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)C3=NC=C(C=N3)OCCCCCC4CCCC4

InChI

InChI=1S/C33H48N2O3/c1-2-3-4-6-12-27-15-17-29(18-16-27)33(36)38-30-21-19-28(20-22-30)32-34-24-31(25-35-32)37-23-10-5-7-11-26-13-8-9-14-26/h19-22,24-27,29H,2-18,23H2,1H3