2-[2-(bromomethyl)-5-octoxy-phenyl]pyrimidine

Systemtic Name: 2-[2-(bromomethyl)-5-octoxy-phenyl]pyrimidine Openeye Name: 2-[2-(bromomethyl)-5-octoxy-phenyl]pyrimidine CAS Name: 2-[2-(bromomethyl)-5-octoxyphenyl]pyrimidine IUPAC Name: 2-[2-(bromomethyl)-5-octoxyphenyl]pyrimidine Traditional Name: 2-[2-(bromomethyl)-5-octoxy-phenyl]pyrimidine Formula: C19H25BrN2O MolecularWeight: 377.3186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC(=C(C=C1)CBr)C2=NC=CC=N2

Isomeric SMILES

CCCCCCCCOC1=CC(=C(C=C1)CBr)C2=NC=CC=N2

InChI

InChI=1S/C19H25BrN2O/c1-2-3-4-5-6-7-13-23-17-10-9-16(15-20)18(14-17)19-21-11-8-12-22-19/h8-12,14H,2-7,13,15H2,1H3