2-(4-dodecoxy-3-nitro-phenyl)-5-hexyl-pyrimidine

Systemtic Name: 2-(4-dodecoxy-3-nitro-phenyl)-5-hexyl-pyrimidine Openeye Name: 2-(4-dodecoxy-3-nitro-phenyl)-5-hexyl-pyrimidine CAS Name: 2-(4-dodecoxy-3-nitrophenyl)-5-hexylpyrimidine IUPAC Name: 2-(4-dodecoxy-3-nitrophenyl)-5-hexylpyrimidine Traditional Name: 5-hexyl-2-(4-lauryloxy-3-nitro-phenyl)pyrimidine Formula: C28H43N3O3 MolecularWeight: 469.65932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)C2=NC=C(C=N2)CCCCCC)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)C2=NC=C(C=N2)CCCCCC)[N+](=O)[O-]

InChI

InChI=1S/C28H43N3O3/c1-3-5-7-9-10-11-12-13-14-16-20-34-27-19-18-25(21-26(27)31(32)33)28-29-22-24(23-30-28)17-15-8-6-4-2/h18-19,21-23H,3-17,20H2,1-2H3