5-heptyl-2-[4-[3-(4-methylcyclohexyl)propoxy]phenyl]pyrimidine

Systemtic Name: 5-heptyl-2-[4-[3-(4-methylcyclohexyl)propoxy]phenyl]pyrimidine Openeye Name: 5-heptyl-2-[4-[3-(4-methylcyclohexyl)propoxy]phenyl]pyrimidine CAS Name: 5-heptyl-2-[4-[3-(4-methylcyclohexyl)propoxy]phenyl]pyrimidine IUPAC Name: 5-heptyl-2-[4-[3-(4-methylcyclohexyl)propoxy]phenyl]pyrimidine Traditional Name: 5-heptyl-2-[4-[3-(4-methylcyclohexyl)propoxy]phenyl]pyrimidine Formula: C27H40N2O MolecularWeight: 408.6193

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCC3CCC(CC3)C

Isomeric SMILES

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCC3CCC(CC3)C

InChI

InChI=1S/C27H40N2O/c1-3-4-5-6-7-9-24-20-28-27(29-21-24)25-15-17-26(18-16-25)30-19-8-10-23-13-11-22(2)12-14-23/h15-18,20-23H,3-14,19H2,1-2H3