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

Systemtic Name: 2-[4-(3-chloranylbutoxy)phenyl]-5-dodecyl-pyrimidine Openeye Name: 2-[4-(3-chlorobutoxy)phenyl]-5-dodecyl-pyrimidine CAS Name: 2-[4-(3-chlorobutoxy)phenyl]-5-dodecylpyrimidine IUPAC Name: 2-[4-(3-chlorobutoxy)phenyl]-5-dodecylpyrimidine Traditional Name: 2-[4-(3-chlorobutoxy)phenyl]-5-lauryl-pyrimidine Formula: C26H39ClN2O MolecularWeight: 431.05366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(C)Cl

Isomeric SMILES

CCCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(C)Cl

InChI

InChI=1S/C26H39ClN2O/c1-3-4-5-6-7-8-9-10-11-12-13-23-20-28-26(29-21-23)24-14-16-25(17-15-24)30-19-18-22(2)27/h14-17,20-22H,3-13,18-19H2,1-2H3