5-dodecyl-2-[4-[(4-pentylphenoxy)methyl]cyclohexyl]pyrimidine

Systemtic Name: 5-dodecyl-2-[4-[(4-pentylphenoxy)methyl]cyclohexyl]pyrimidine Openeye Name: 5-dodecyl-2-[4-[(4-pentylphenoxy)methyl]cyclohexyl]pyrimidine CAS Name: 5-dodecyl-2-[4-[(4-pentylphenoxy)methyl]cyclohexyl]pyrimidine IUPAC Name: 5-dodecyl-2-[4-[(4-pentylphenoxy)methyl]cyclohexyl]pyrimidine Traditional Name: 2-[4-[(4-amylphenoxy)methyl]cyclohexyl]-5-lauryl-pyrimidine Formula: C34H54N2O MolecularWeight: 506.80536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CN=C(N=C1)C2CCC(CC2)COC3=CC=C(C=C3)CCCCC

Isomeric SMILES

CCCCCCCCCCCCC1=CN=C(N=C1)C2CCC(CC2)COC3=CC=C(C=C3)CCCCC

InChI

InChI=1S/C34H54N2O/c1-3-5-7-8-9-10-11-12-13-15-17-31-26-35-34(36-27-31)32-22-18-30(19-23-32)28-37-33-24-20-29(21-25-33)16-14-6-4-2/h20-21,24-27,30,32H,3-19,22-23,28H2,1-2H3