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

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

Systemtic Name:5-decyl-2-[4-[(3S)-3-methylpentoxy]phenyl]pyrimidine
Openeye Name:5-decyl-2-[4-[(3S)-3-methylpentoxy]phenyl]pyrimidine
CAS Name:5-decyl-2-[4-[(3S)-3-methylpentoxy]phenyl]pyrimidine
IUPAC Name:5-decyl-2-[4-[(3S)-3-methylpentoxy]phenyl]pyrimidine
Traditional Name:5-decyl-2-[4-[(3S)-3-methylpentoxy]phenyl]pyrimidine
Formula: C26H40N2O
MolecularWeight: 396.6086
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC[C@@H](C)CC


InChI

InChI=1S/C26H40N2O/c1-4-6-7-8-9-10-11-12-13-23-20-27-26(28-21-23)24-14-16-25(17-15-24)29-19-18-22(3)5-2/h14-17,20-22H,4-13,18-19H2,1-3H3/t22-/m0/s1


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