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

Systemtic Name: [2-(5-octoxypyrimidin-2-yl)phenyl] 4-pentylcyclohexane-1-carboxylate Openeye Name: [2-(5-octoxypyrimidin-2-yl)phenyl] 4-pentylcyclohexanecarboxylate CAS Name: 4-pentyl-1-cyclohexanecarboxylic acid [2-(5-octoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [2-(5-octoxypyrimidin-2-yl)phenyl] 4-pentylcyclohexane-1-carboxylate Traditional Name: 4-amylcyclohexanecarboxylic acid [2-(5-octoxypyrimidin-2-yl)phenyl] ester Formula: C30H44N2O3 MolecularWeight: 480.68196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CN=C(N=C1)C2=CC=CC=C2OC(=O)C3CCC(CC3)CCCCC

Isomeric SMILES

CCCCCCCCOC1=CN=C(N=C1)C2=CC=CC=C2OC(=O)C3CCC(CC3)CCCCC

InChI

InChI=1S/C30H44N2O3/c1-3-5-7-8-9-13-21-34-26-22-31-29(32-23-26)27-15-11-12-16-28(27)35-30(33)25-19-17-24(18-20-25)14-10-6-4-2/h11-12,15-16,22-25H,3-10,13-14,17-21H2,1-2H3