2-(2-decoxyphenyl)-5-heptyl-pyrimidine

Systemtic Name: 2-(2-decoxyphenyl)-5-heptyl-pyrimidine Openeye Name: 2-(2-decoxyphenyl)-5-heptyl-pyrimidine CAS Name: 2-(2-decoxyphenyl)-5-heptylpyrimidine IUPAC Name: 2-(2-decoxyphenyl)-5-heptylpyrimidine Traditional Name: 2-(2-decoxyphenyl)-5-heptyl-pyrimidine Formula: C27H42N2O MolecularWeight: 410.63518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=CC=C1C2=NC=C(C=N2)CCCCCCC

Isomeric SMILES

CCCCCCCCCCOC1=CC=CC=C1C2=NC=C(C=N2)CCCCCCC

InChI

InChI=1S/C27H42N2O/c1-3-5-7-9-10-11-13-17-21-30-26-20-16-15-19-25(26)27-28-22-24(23-29-27)18-14-12-8-6-4-2/h15-16,19-20,22-23H,3-14,17-18,21H2,1-2H3