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

Systemtic Name: [4-(5-undecylpyrimidin-2-yl)phenyl] 4-pentylcyclohexane-1-carboxylate Openeye Name: [4-(5-undecylpyrimidin-2-yl)phenyl] 4-pentylcyclohexanecarboxylate CAS Name: 4-pentyl-1-cyclohexanecarboxylic acid [4-(5-undecyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-undecylpyrimidin-2-yl)phenyl] 4-pentylcyclohexane-1-carboxylate Traditional Name: 4-amylcyclohexanecarboxylic acid [4-(5-undecylpyrimidin-2-yl)phenyl] ester Formula: C33H50N2O2 MolecularWeight: 506.7623

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C3CCC(CC3)CCCCC

Isomeric SMILES

CCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C3CCC(CC3)CCCCC

InChI

InChI=1S/C33H50N2O2/c1-3-5-7-8-9-10-11-12-14-16-28-25-34-32(35-26-28)29-21-23-31(24-22-29)37-33(36)30-19-17-27(18-20-30)15-13-6-4-2/h21-27,30H,3-20H2,1-2H3