[2-[4-(4-pentylcyclohexyl)phenyl]pyrimidin-5-yl] dodecanoate

Systemtic Name: [2-[4-(4-pentylcyclohexyl)phenyl]pyrimidin-5-yl] dodecanoate Openeye Name: [2-[4-(4-pentylcyclohexyl)phenyl]pyrimidin-5-yl] dodecanoate CAS Name: dodecanoic acid [2-[4-(4-pentylcyclohexyl)phenyl]-5-pyrimidinyl] ester IUPAC Name: [2-[4-(4-pentylcyclohexyl)phenyl]pyrimidin-5-yl] dodecanoate Traditional Name: lauric acid [2-[4-(4-amylcyclohexyl)phenyl]pyrimidin-5-yl] ester Formula: C33H50N2O2 MolecularWeight: 506.7623

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC1=CN=C(N=C1)C2=CC=C(C=C2)C3CCC(CC3)CCCCC

Isomeric SMILES

CCCCCCCCCCCC(=O)OC1=CN=C(N=C1)C2=CC=C(C=C2)C3CCC(CC3)CCCCC

InChI

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