5-decyl-2-[4-(6-octoxyheptoxy)phenyl]pyrimidine

Systemtic Name: 5-decyl-2-[4-(6-octoxyheptoxy)phenyl]pyrimidine Openeye Name: 5-decyl-2-[4-(6-octoxyheptoxy)phenyl]pyrimidine CAS Name: 5-decyl-2-[4-(6-octoxyheptoxy)phenyl]pyrimidine IUPAC Name: 5-decyl-2-[4-(6-octoxyheptoxy)phenyl]pyrimidine Traditional Name: 5-decyl-2-[4-(6-octoxyheptoxy)phenyl]pyrimidine Formula: C35H58N2O2 MolecularWeight: 538.84722

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCCCC(C)OCCCCCCCC

Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCCCC(C)OCCCCCCCC

InChI

InChI=1S/C35H58N2O2/c1-4-6-8-10-12-13-14-18-22-32-29-36-35(37-30-32)33-23-25-34(26-24-33)39-28-20-16-17-21-31(3)38-27-19-15-11-9-7-5-2/h23-26,29-31H,4-22,27-28H2,1-3H3