2-[4-(3-chloranylbutoxy)phenyl]-5-hexyl-pyrimidine

Systemtic Name: 2-[4-(3-chloranylbutoxy)phenyl]-5-hexyl-pyrimidine Openeye Name: 2-[4-(3-chlorobutoxy)phenyl]-5-hexyl-pyrimidine CAS Name: 2-[4-(3-chlorobutoxy)phenyl]-5-hexylpyrimidine IUPAC Name: 2-[4-(3-chlorobutoxy)phenyl]-5-hexylpyrimidine Traditional Name: 2-[4-(3-chlorobutoxy)phenyl]-5-hexyl-pyrimidine Formula: C20H27ClN2O MolecularWeight: 346.89418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(C)Cl

Isomeric SMILES

CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(C)Cl

InChI

InChI=1S/C20H27ClN2O/c1-3-4-5-6-7-17-14-22-20(23-15-17)18-8-10-19(11-9-18)24-13-12-16(2)21/h8-11,14-16H,3-7,12-13H2,1-2H3