2-[2-(3-chloranylpentoxy)phenyl]-4-hexyl-pyrimidine

Systemtic Name: 2-[2-(3-chloranylpentoxy)phenyl]-4-hexyl-pyrimidine Openeye Name: 2-[2-(3-chloropentoxy)phenyl]-4-hexyl-pyrimidine CAS Name: 2-[2-(3-chloropentoxy)phenyl]-4-hexylpyrimidine IUPAC Name: 2-[2-(3-chloropentoxy)phenyl]-4-hexylpyrimidine Traditional Name: 2-[2-(3-chloropentoxy)phenyl]-4-hexyl-pyrimidine Formula: C21H29ClN2O MolecularWeight: 360.92076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=NC(=NC=C1)C2=CC=CC=C2OCCC(CC)Cl

Isomeric SMILES

CCCCCCC1=NC(=NC=C1)C2=CC=CC=C2OCCC(CC)Cl

InChI

InChI=1S/C21H29ClN2O/c1-3-5-6-7-10-18-13-15-23-21(24-18)19-11-8-9-12-20(19)25-16-14-17(22)4-2/h8-9,11-13,15,17H,3-7,10,14,16H2,1-2H3