2-(4-dodecoxyphenyl)-5-[4-(2-fluoranyl-4-methyl-pentoxy)phenyl]pyrimidine

Systemtic Name: 2-(4-dodecoxyphenyl)-5-[4-(2-fluoranyl-4-methyl-pentoxy)phenyl]pyrimidine Openeye Name: 2-(4-dodecoxyphenyl)-5-[4-(2-fluoro-4-methyl-pentoxy)phenyl]pyrimidine CAS Name: 2-(4-dodecoxyphenyl)-5-[4-(2-fluoro-4-methylpentoxy)phenyl]pyrimidine IUPAC Name: 2-(4-dodecoxyphenyl)-5-[4-(2-fluoro-4-methylpentoxy)phenyl]pyrimidine Traditional Name: 5-[4-(2-fluoro-4-methyl-pentoxy)phenyl]-2-(4-lauryloxyphenyl)pyrimidine Formula: C34H47FN2O2 MolecularWeight: 534.747583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CC(C)C)F

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CC(C)C)F

InChI

InChI=1S/C34H47FN2O2/c1-4-5-6-7-8-9-10-11-12-13-22-38-32-20-16-29(17-21-32)34-36-24-30(25-37-34)28-14-18-33(19-15-28)39-26-31(35)23-27(2)3/h14-21,24-25,27,31H,4-13,22-23,26H2,1-3H3