5-(4-ethoxyphenyl)-2-[2-(4-heptylcyclohexyl)ethyl]pyrimidine

Systemtic Name: 5-(4-ethoxyphenyl)-2-[2-(4-heptylcyclohexyl)ethyl]pyrimidine Openeye Name: 5-(4-ethoxyphenyl)-2-[2-(4-heptylcyclohexyl)ethyl]pyrimidine CAS Name: 5-(4-ethoxyphenyl)-2-[2-(4-heptylcyclohexyl)ethyl]pyrimidine IUPAC Name: 5-(4-ethoxyphenyl)-2-[2-(4-heptylcyclohexyl)ethyl]pyrimidine Traditional Name: 2-[2-(4-heptylcyclohexyl)ethyl]-5-p-phenetyl-pyrimidine Formula: C27H40N2O MolecularWeight: 408.6193

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)CCC2=NC=C(C=N2)C3=CC=C(C=C3)OCC

Isomeric SMILES

CCCCCCCC1CCC(CC1)CCC2=NC=C(C=N2)C3=CC=C(C=C3)OCC

InChI

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