5-decyl-2-[4-(3-fluoranyl-4-methyl-hexoxy)phenyl]pyrimidine

Systemtic Name: 5-decyl-2-[4-(3-fluoranyl-4-methyl-hexoxy)phenyl]pyrimidine Openeye Name: 5-decyl-2-[4-(3-fluoro-4-methyl-hexoxy)phenyl]pyrimidine CAS Name: 5-decyl-2-[4-(3-fluoro-4-methylhexoxy)phenyl]pyrimidine IUPAC Name: 5-decyl-2-[4-(3-fluoro-4-methylhexoxy)phenyl]pyrimidine Traditional Name: 5-decyl-2-[4-(3-fluoro-4-methyl-hexoxy)phenyl]pyrimidine Formula: C27H41FN2O MolecularWeight: 428.625643

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(C(C)CC)F

Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(C(C)CC)F

InChI

InChI=1S/C27H41FN2O/c1-4-6-7-8-9-10-11-12-13-23-20-29-27(30-21-23)24-14-16-25(17-15-24)31-19-18-26(28)22(3)5-2/h14-17,20-22,26H,4-13,18-19H2,1-3H3