5-[2-(3-chloranyl-4-pentyl-phenyl)ethyl]-2-pentyl-pyrimidine

Systemtic Name: 5-[2-(3-chloranyl-4-pentyl-phenyl)ethyl]-2-pentyl-pyrimidine Openeye Name: 5-[2-(3-chloro-4-pentyl-phenyl)ethyl]-2-pentyl-pyrimidine CAS Name: 5-[2-(3-chloro-4-pentylphenyl)ethyl]-2-pentylpyrimidine IUPAC Name: 5-[2-(3-chloro-4-pentylphenyl)ethyl]-2-pentylpyrimidine Traditional Name: 2-amyl-5-[2-(4-amyl-3-chloro-phenyl)ethyl]pyrimidine Formula: C22H31ClN2 MolecularWeight: 358.94794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=C(C=C1)CCC2=CN=C(N=C2)CCCCC)Cl

Isomeric SMILES

CCCCCC1=C(C=C(C=C1)CCC2=CN=C(N=C2)CCCCC)Cl

InChI

InChI=1S/C22H31ClN2/c1-3-5-7-9-20-14-13-18(15-21(20)23)11-12-19-16-24-22(25-17-19)10-8-6-4-2/h13-17H,3-12H2,1-2H3