2-(4-dodecylphenyl)-5-(3-fluoranyl-7-methyl-decoxy)pyrimidine

Systemtic Name: 2-(4-dodecylphenyl)-5-(3-fluoranyl-7-methyl-decoxy)pyrimidine Openeye Name: 2-(4-dodecylphenyl)-5-(3-fluoro-7-methyl-decoxy)pyrimidine CAS Name: 2-(4-dodecylphenyl)-5-(3-fluoro-7-methyldecoxy)pyrimidine IUPAC Name: 2-(4-dodecylphenyl)-5-(3-fluoro-7-methyldecoxy)pyrimidine Traditional Name: 5-(3-fluoro-7-methyl-decoxy)-2-(4-laurylphenyl)pyrimidine Formula: C33H53FN2O MolecularWeight: 512.785123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCC(CCCC(C)CCC)F

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCC(CCCC(C)CCC)F

InChI

InChI=1S/C33H53FN2O/c1-4-6-7-8-9-10-11-12-13-14-18-29-20-22-30(23-21-29)33-35-26-32(27-36-33)37-25-24-31(34)19-15-17-28(3)16-5-2/h20-23,26-28,31H,4-19,24-25H2,1-3H3