2-[4-(5-bromanylpentoxy)phenyl]-5-hexyl-pyrimidine

Systemtic Name: 2-[4-(5-bromanylpentoxy)phenyl]-5-hexyl-pyrimidine Openeye Name: 2-[4-(5-bromopentoxy)phenyl]-5-hexyl-pyrimidine CAS Name: 2-[4-(5-bromopentoxy)phenyl]-5-hexylpyrimidine IUPAC Name: 2-[4-(5-bromopentoxy)phenyl]-5-hexylpyrimidine Traditional Name: 2-[4-(5-bromopentoxy)phenyl]-5-hexyl-pyrimidine Formula: C21H29BrN2O MolecularWeight: 405.37176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCCCBr

Isomeric SMILES

CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCCCBr

InChI

InChI=1S/C21H29BrN2O/c1-2-3-4-6-9-18-16-23-21(24-17-18)19-10-12-20(13-11-19)25-15-8-5-7-14-22/h10-13,16-17H,2-9,14-15H2,1H3