2-(4-octan-2-yloxyphenyl)-5-propoxy-pyrimidine

Systemtic Name: 2-(4-octan-2-yloxyphenyl)-5-propoxy-pyrimidine Openeye Name: 2-[4-(1-methylheptoxy)phenyl]-5-propoxy-pyrimidine CAS Name: 2-(4-octan-2-yloxyphenyl)-5-propoxypyrimidine IUPAC Name: 2-(4-octan-2-yloxyphenyl)-5-propoxypyrimidine Traditional Name: 2-[4-(1-methylheptoxy)phenyl]-5-propoxy-pyrimidine Formula: C21H30N2O2 MolecularWeight: 342.4751

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC1=CC=C(C=C1)C2=NC=C(C=N2)OCCC

Isomeric SMILES

CCCCCCC(C)OC1=CC=C(C=C1)C2=NC=C(C=N2)OCCC

InChI

InChI=1S/C21H30N2O2/c1-4-6-7-8-9-17(3)25-19-12-10-18(11-13-19)21-22-15-20(16-23-21)24-14-5-2/h10-13,15-17H,4-9,14H2,1-3H3