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5-(heptoxymethyl)-4-[2-(6-methyloctoxy)phenyl]pyrimidine

5-(heptoxymethyl)-4-[2-(6-methyloctoxy)phenyl]pyrimidine

Systemtic Name:5-(heptoxymethyl)-4-[2-(6-methyloctoxy)phenyl]pyrimidine
Openeye Name:5-(heptoxymethyl)-4-[2-(6-methyloctoxy)phenyl]pyrimidine
CAS Name:5-(heptoxymethyl)-4-[2-(6-methyloctoxy)phenyl]pyrimidine
IUPAC Name:5-(heptoxymethyl)-4-[2-(6-methyloctoxy)phenyl]pyrimidine
Traditional Name:5-(heptoxymethyl)-4-[2-(6-methyloctoxy)phenyl]pyrimidine
Formula: C27H42N2O2
MolecularWeight: 426.63458
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOCC1=CN=CN=C1C2=CC=CC=C2OCCCCCC(C)CC


Isomeric SMILES

CCCCCCCOCC1=CN=CN=C1C2=CC=CC=C2OCCCCCC(C)CC


InChI

InChI=1S/C27H42N2O2/c1-4-6-7-8-13-18-30-21-24-20-28-22-29-27(24)25-16-11-12-17-26(25)31-19-14-9-10-15-23(3)5-2/h11-12,16-17,20,22-23H,4-10,13-15,18-19,21H2,1-3H3


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