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5-dodecyl-2-[4-[(3S)-3-methylpentoxy]phenyl]pyrimidine

5-dodecyl-2-[4-[(3S)-3-methylpentoxy]phenyl]pyrimidine

Systemtic Name:5-dodecyl-2-[4-[(3S)-3-methylpentoxy]phenyl]pyrimidine
Openeye Name:5-dodecyl-2-[4-[(3S)-3-methylpentoxy]phenyl]pyrimidine
CAS Name:5-dodecyl-2-[4-[(3S)-3-methylpentoxy]phenyl]pyrimidine
IUPAC Name:5-dodecyl-2-[4-[(3S)-3-methylpentoxy]phenyl]pyrimidine
Traditional Name:5-lauryl-2-[4-[(3S)-3-methylpentoxy]phenyl]pyrimidine
Formula: C28H44N2O
MolecularWeight: 424.66176
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(C)CC


Isomeric SMILES

CCCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC[C@@H](C)CC


InChI

InChI=1S/C28H44N2O/c1-4-6-7-8-9-10-11-12-13-14-15-25-22-29-28(30-23-25)26-16-18-27(19-17-26)31-21-20-24(3)5-2/h16-19,22-24H,4-15,20-21H2,1-3H3/t24-/m0/s1


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