2-[2-(4-ethylcyclohexyl)ethyl]-5-(4-heptoxyphenyl)pyrimidine

Systemtic Name: 2-[2-(4-ethylcyclohexyl)ethyl]-5-(4-heptoxyphenyl)pyrimidine Openeye Name: 2-[2-(4-ethylcyclohexyl)ethyl]-5-(4-heptoxyphenyl)pyrimidine CAS Name: 2-[2-(4-ethylcyclohexyl)ethyl]-5-(4-heptoxyphenyl)pyrimidine IUPAC Name: 2-[2-(4-ethylcyclohexyl)ethyl]-5-(4-heptoxyphenyl)pyrimidine Traditional Name: 2-[2-(4-ethylcyclohexyl)ethyl]-5-(4-heptoxyphenyl)pyrimidine Formula: C27H40N2O MolecularWeight: 408.6193

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=CN=C(N=C2)CCC3CCC(CC3)CC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=CN=C(N=C2)CCC3CCC(CC3)CC

InChI

InChI=1S/C27H40N2O/c1-3-5-6-7-8-19-30-26-16-14-24(15-17-26)25-20-28-27(29-21-25)18-13-23-11-9-22(4-2)10-12-23/h14-17,20-23H,3-13,18-19H2,1-2H3