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

Systemtic Name: 2-[2-(3-chloranylpentoxy)phenyl]-4-heptyl-pyrimidine Openeye Name: 2-[2-(3-chloropentoxy)phenyl]-4-heptyl-pyrimidine CAS Name: 2-[2-(3-chloropentoxy)phenyl]-4-heptylpyrimidine IUPAC Name: 2-[2-(3-chloropentoxy)phenyl]-4-heptylpyrimidine Traditional Name: 2-[2-(3-chloropentoxy)phenyl]-4-heptyl-pyrimidine Formula: C22H31ClN2O MolecularWeight: 374.94734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=NC(=NC=C1)C2=CC=CC=C2OCCC(CC)Cl

Isomeric SMILES

CCCCCCCC1=NC(=NC=C1)C2=CC=CC=C2OCCC(CC)Cl

InChI

InChI=1S/C22H31ClN2O/c1-3-5-6-7-8-11-19-14-16-24-22(25-19)20-12-9-10-13-21(20)26-17-15-18(23)4-2/h9-10,12-14,16,18H,3-8,11,15,17H2,1-2H3