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

Systemtic Name: [2-(5-dodecylpyrimidin-2-yl)phenyl] 4-pentylcyclohexane-1-carboxylate Openeye Name: [2-(5-dodecylpyrimidin-2-yl)phenyl] 4-pentylcyclohexanecarboxylate CAS Name: 4-pentyl-1-cyclohexanecarboxylic acid [2-(5-dodecyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [2-(5-dodecylpyrimidin-2-yl)phenyl] 4-pentylcyclohexane-1-carboxylate Traditional Name: 4-amylcyclohexanecarboxylic acid [2-(5-laurylpyrimidin-2-yl)phenyl] ester Formula: C34H52N2O2 MolecularWeight: 520.78888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CN=C(N=C1)C2=CC=CC=C2OC(=O)C3CCC(CC3)CCCCC

Isomeric SMILES

CCCCCCCCCCCCC1=CN=C(N=C1)C2=CC=CC=C2OC(=O)C3CCC(CC3)CCCCC

InChI

InChI=1S/C34H52N2O2/c1-3-5-7-8-9-10-11-12-13-15-19-29-26-35-33(36-27-29)31-20-16-17-21-32(31)38-34(37)30-24-22-28(23-25-30)18-14-6-4-2/h16-17,20-21,26-28,30H,3-15,18-19,22-25H2,1-2H3