[2-(5-undecoxypyrimidin-2-yl)phenyl] 4-pentylcyclohexane-1-carboxylate

Systemtic Name: [2-(5-undecoxypyrimidin-2-yl)phenyl] 4-pentylcyclohexane-1-carboxylate Openeye Name: [2-(5-undecoxypyrimidin-2-yl)phenyl] 4-pentylcyclohexanecarboxylate CAS Name: 4-pentyl-1-cyclohexanecarboxylic acid [2-(5-undecoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [2-(5-undecoxypyrimidin-2-yl)phenyl] 4-pentylcyclohexane-1-carboxylate Traditional Name: 4-amylcyclohexanecarboxylic acid [2-(5-undecoxypyrimidin-2-yl)phenyl] ester Formula: C33H50N2O3 MolecularWeight: 522.7617

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC1=CN=C(N=C1)C2=CC=CC=C2OC(=O)C3CCC(CC3)CCCCC

Isomeric SMILES

CCCCCCCCCCCOC1=CN=C(N=C1)C2=CC=CC=C2OC(=O)C3CCC(CC3)CCCCC

InChI

InChI=1S/C33H50N2O3/c1-3-5-7-8-9-10-11-12-16-24-37-29-25-34-32(35-26-29)30-18-14-15-19-31(30)38-33(36)28-22-20-27(21-23-28)17-13-6-4-2/h14-15,18-19,25-28H,3-13,16-17,20-24H2,1-2H3