5-hexyl-2-[4-[4-(4-pentylcyclohexyl)butyl]phenyl]pyrimidine

Systemtic Name: 5-hexyl-2-[4-[4-(4-pentylcyclohexyl)butyl]phenyl]pyrimidine Openeye Name: 5-hexyl-2-[4-[4-(4-pentylcyclohexyl)butyl]phenyl]pyrimidine CAS Name: 5-hexyl-2-[4-[4-(4-pentylcyclohexyl)butyl]phenyl]pyrimidine IUPAC Name: 5-hexyl-2-[4-[4-(4-pentylcyclohexyl)butyl]phenyl]pyrimidine Traditional Name: 2-[4-[4-(4-amylcyclohexyl)butyl]phenyl]-5-hexyl-pyrimidine Formula: C31H48N2 MolecularWeight: 448.72622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCC3CCC(CC3)CCCCC

Isomeric SMILES

CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCC3CCC(CC3)CCCCC

InChI

InChI=1S/C31H48N2/c1-3-5-7-9-15-29-24-32-31(33-25-29)30-22-20-28(21-23-30)14-11-10-13-27-18-16-26(17-19-27)12-8-6-4-2/h20-27H,3-19H2,1-2H3