4-chloranyl-2-octoxy-6-phenyl-5-phenylmethoxy-pyrimidine

Systemtic Name: 4-chloranyl-2-octoxy-6-phenyl-5-phenylmethoxy-pyrimidine Openeye Name: 5-benzyloxy-4-chloro-2-octoxy-6-phenyl-pyrimidine CAS Name: 4-chloro-2-octoxy-6-phenyl-5-phenylmethoxypyrimidine IUPAC Name: 4-chloro-2-octoxy-6-phenyl-5-phenylmethoxypyrimidine Traditional Name: 5-benzoxy-4-chloro-2-octoxy-6-phenyl-pyrimidine Formula: C25H29ClN2O2 MolecularWeight: 424.96296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=NC(=C(C(=N1)Cl)OCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCOC1=NC(=C(C(=N1)Cl)OCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H29ClN2O2/c1-2-3-4-5-6-13-18-29-25-27-22(21-16-11-8-12-17-21)23(24(26)28-25)30-19-20-14-9-7-10-15-20/h7-12,14-17H,2-6,13,18-19H2,1H3