[4-(5-undecylpyrimidin-2-yl)phenyl] cyclopentanecarboxylate

Systemtic Name: [4-(5-undecylpyrimidin-2-yl)phenyl] cyclopentanecarboxylate Openeye Name: [4-(5-undecylpyrimidin-2-yl)phenyl] cyclopentanecarboxylate CAS Name: cyclopentanecarboxylic acid [4-(5-undecyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-undecylpyrimidin-2-yl)phenyl] cyclopentanecarboxylate Traditional Name: cyclopentanecarboxylic acid [4-(5-undecylpyrimidin-2-yl)phenyl] ester Formula: C27H38N2O2 MolecularWeight: 422.60282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C3CCCC3

Isomeric SMILES

CCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C3CCCC3

InChI

InChI=1S/C27H38N2O2/c1-2-3-4-5-6-7-8-9-10-13-22-20-28-26(29-21-22)23-16-18-25(19-17-23)31-27(30)24-14-11-12-15-24/h16-21,24H,2-15H2,1H3