5-butyl-2-[4-[3-(4-hexylcyclohexyl)propoxy]phenyl]pyrimidine

Systemtic Name: 5-butyl-2-[4-[3-(4-hexylcyclohexyl)propoxy]phenyl]pyrimidine Openeye Name: 5-butyl-2-[4-[3-(4-hexylcyclohexyl)propoxy]phenyl]pyrimidine CAS Name: 5-butyl-2-[4-[3-(4-hexylcyclohexyl)propoxy]phenyl]pyrimidine IUPAC Name: 5-butyl-2-[4-[3-(4-hexylcyclohexyl)propoxy]phenyl]pyrimidine Traditional Name: 5-butyl-2-[4-[3-(4-hexylcyclohexyl)propoxy]phenyl]pyrimidine Formula: C29H44N2O MolecularWeight: 436.67246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)CCCOC2=CC=C(C=C2)C3=NC=C(C=N3)CCCC

Isomeric SMILES

CCCCCCC1CCC(CC1)CCCOC2=CC=C(C=C2)C3=NC=C(C=N3)CCCC

InChI

InChI=1S/C29H44N2O/c1-3-5-7-8-11-24-13-15-25(16-14-24)12-9-21-32-28-19-17-27(18-20-28)29-30-22-26(23-31-29)10-6-4-2/h17-20,22-25H,3-16,21H2,1-2H3