2-[4-(2-heptoxyethoxy)phenyl]-5-nonyl-pyrimidine

Systemtic Name: 2-[4-(2-heptoxyethoxy)phenyl]-5-nonyl-pyrimidine Openeye Name: 2-[4-(2-heptoxyethoxy)phenyl]-5-nonyl-pyrimidine CAS Name: 2-[4-(2-heptoxyethoxy)phenyl]-5-nonylpyrimidine IUPAC Name: 2-[4-(2-heptoxyethoxy)phenyl]-5-nonylpyrimidine Traditional Name: 2-[4-(2-heptoxyethoxy)phenyl]-5-nonyl-pyrimidine Formula: C28H44N2O2 MolecularWeight: 440.66116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCOCCCCCCC

Isomeric SMILES

CCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCOCCCCCCC

InChI

InChI=1S/C28H44N2O2/c1-3-5-7-9-10-11-13-15-25-23-29-28(30-24-25)26-16-18-27(19-17-26)32-22-21-31-20-14-12-8-6-4-2/h16-19,23-24H,3-15,20-22H2,1-2H3