[4-(5-decylpyrimidin-2-yl)phenyl] cyclohexanecarboxylate

Systemtic Name: [4-(5-decylpyrimidin-2-yl)phenyl] cyclohexanecarboxylate Openeye Name: [4-(5-decylpyrimidin-2-yl)phenyl] cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [4-(5-decyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-decylpyrimidin-2-yl)phenyl] cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [4-(5-decylpyrimidin-2-yl)phenyl] ester Formula: C27H38N2O2 MolecularWeight: 422.60282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C3CCCCC3

Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C3CCCCC3

InChI

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