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

Systemtic Name: 5-heptyl-2-[4-(6-methyloctoxy)phenyl]pyrimidine Openeye Name: 5-heptyl-2-[4-(6-methyloctoxy)phenyl]pyrimidine CAS Name: 5-heptyl-2-[4-(6-methyloctoxy)phenyl]pyrimidine IUPAC Name: 5-heptyl-2-[4-(6-methyloctoxy)phenyl]pyrimidine Traditional Name: 5-heptyl-2-[4-(6-methyloctoxy)phenyl]pyrimidine Formula: C26H40N2O MolecularWeight: 396.6086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCCCC(C)CC

Isomeric SMILES

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCCCC(C)CC

InChI

InChI=1S/C26H40N2O/c1-4-6-7-8-11-14-23-20-27-26(28-21-23)24-15-17-25(18-16-24)29-19-12-9-10-13-22(3)5-2/h15-18,20-22H,4-14,19H2,1-3H3