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

Systemtic Name: 2-[2-(3-chloranyl-4-pentyl-phenyl)ethyl]-5-pentyl-pyrimidine Openeye Name: 2-[2-(3-chloro-4-pentyl-phenyl)ethyl]-5-pentyl-pyrimidine CAS Name: 2-[2-(3-chloro-4-pentylphenyl)ethyl]-5-pentylpyrimidine IUPAC Name: 2-[2-(3-chloro-4-pentylphenyl)ethyl]-5-pentylpyrimidine Traditional Name: 5-amyl-2-[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=NC=C(C=N2)CCCCC)Cl

Isomeric SMILES

CCCCCC1=C(C=C(C=C1)CCC2=NC=C(C=N2)CCCCC)Cl

InChI

InChI=1S/C22H31ClN2/c1-3-5-7-9-19-16-24-22(25-17-19)14-12-18-11-13-20(21(23)15-18)10-8-6-4-2/h11,13,15-17H,3-10,12,14H2,1-2H3