2-[4-[3-(4-butylcyclohexyl)propoxy]phenyl]-5-pentyl-pyrimidine

Systemtic Name: 2-[4-[3-(4-butylcyclohexyl)propoxy]phenyl]-5-pentyl-pyrimidine Openeye Name: 2-[4-[3-(4-butylcyclohexyl)propoxy]phenyl]-5-pentyl-pyrimidine CAS Name: 2-[4-[3-(4-butylcyclohexyl)propoxy]phenyl]-5-pentylpyrimidine IUPAC Name: 2-[4-[3-(4-butylcyclohexyl)propoxy]phenyl]-5-pentylpyrimidine Traditional Name: 5-amyl-2-[4-[3-(4-butylcyclohexyl)propoxy]phenyl]pyrimidine Formula: C28H42N2O MolecularWeight: 422.64588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCC3CCC(CC3)CCCC

Isomeric SMILES

CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCC3CCC(CC3)CCCC

InChI

InChI=1S/C28H42N2O/c1-3-5-7-10-25-21-29-28(30-22-25)26-16-18-27(19-17-26)31-20-8-11-24-14-12-23(13-15-24)9-6-4-2/h16-19,21-24H,3-15,20H2,1-2H3