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5-dodecoxy-2-(2-fluoranyl-4-heptoxy-phenyl)pyrimidine

Systemtic Name:	5-dodecoxy-2-(2-fluoranyl-4-heptoxy-phenyl)pyrimidine
Openeye Name:	5-dodecoxy-2-(2-fluoro-4-heptoxy-phenyl)pyrimidine
CAS Name:	5-dodecoxy-2-(2-fluoro-4-heptoxyphenyl)pyrimidine
IUPAC Name:	5-dodecoxy-2-(2-fluoro-4-heptoxyphenyl)pyrimidine
Traditional Name:	2-(2-fluoro-4-heptoxy-phenyl)-5-lauryloxy-pyrimidine
Formula:	C₂₉H₄₅FN₂O₂
MolecularWeight:	472.678203

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CN=C(N=C1)C2=C(C=C(C=C2)OCCCCCCC)F

Isomeric SMILES

CCCCCCCCCCCCOC1=CN=C(N=C1)C2=C(C=C(C=C2)OCCCCCCC)F

InChI

InChI=1S/C29H45FN2O2/c1-3-5-7-9-10-11-12-13-15-17-21-34-26-23-31-29(32-24-26)27-19-18-25(22-28(27)30)33-20-16-14-8-6-4-2/h18-19,22-24H,3-17,20-21H2,1-2H3

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