[2-(2-dodecoxyphenyl)pyrimidin-5-yl] 4-pentylcyclohexane-1-carboxylate

Systemtic Name: [2-(2-dodecoxyphenyl)pyrimidin-5-yl] 4-pentylcyclohexane-1-carboxylate Openeye Name: [2-(2-dodecoxyphenyl)pyrimidin-5-yl] 4-pentylcyclohexanecarboxylate CAS Name: 4-pentyl-1-cyclohexanecarboxylic acid [2-(2-dodecoxyphenyl)-5-pyrimidinyl] ester IUPAC Name: [2-(2-dodecoxyphenyl)pyrimidin-5-yl] 4-pentylcyclohexane-1-carboxylate Traditional Name: 4-amylcyclohexanecarboxylic acid [2-(2-lauryloxyphenyl)pyrimidin-5-yl] ester Formula: C34H52N2O3 MolecularWeight: 536.78828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=CC=C1C2=NC=C(C=N2)OC(=O)C3CCC(CC3)CCCCC

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=CC=C1C2=NC=C(C=N2)OC(=O)C3CCC(CC3)CCCCC

InChI

InChI=1S/C34H52N2O3/c1-3-5-7-8-9-10-11-12-13-17-25-38-32-20-16-15-19-31(32)33-35-26-30(27-36-33)39-34(37)29-23-21-28(22-24-29)18-14-6-4-2/h15-16,19-20,26-29H,3-14,17-18,21-25H2,1-2H3