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

Systemtic Name: 5-[2-(4-butylcyclohexyl)ethyl]-4-(2-heptoxyphenyl)pyrimidine Openeye Name: 5-[2-(4-butylcyclohexyl)ethyl]-4-(2-heptoxyphenyl)pyrimidine CAS Name: 5-[2-(4-butylcyclohexyl)ethyl]-4-(2-heptoxyphenyl)pyrimidine IUPAC Name: 5-[2-(4-butylcyclohexyl)ethyl]-4-(2-heptoxyphenyl)pyrimidine Traditional Name: 5-[2-(4-butylcyclohexyl)ethyl]-4-(2-heptoxyphenyl)pyrimidine Formula: C29H44N2O MolecularWeight: 436.67246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=CC=C1C2=NC=NC=C2CCC3CCC(CC3)CCCC

Isomeric SMILES

CCCCCCCOC1=CC=CC=C1C2=NC=NC=C2CCC3CCC(CC3)CCCC

InChI

InChI=1S/C29H44N2O/c1-3-5-7-8-11-21-32-28-14-10-9-13-27(28)29-26(22-30-23-31-29)20-19-25-17-15-24(16-18-25)12-6-4-2/h9-10,13-14,22-25H,3-8,11-12,15-21H2,1-2H3