5-heptyl-4-(2-undecoxyphenyl)pyrimidine

Systemtic Name: 5-heptyl-4-(2-undecoxyphenyl)pyrimidine Openeye Name: 5-heptyl-4-(2-undecoxyphenyl)pyrimidine CAS Name: 5-heptyl-4-(2-undecoxyphenyl)pyrimidine IUPAC Name: 5-heptyl-4-(2-undecoxyphenyl)pyrimidine Traditional Name: 5-heptyl-4-(2-undecoxyphenyl)pyrimidine Formula: C28H44N2O MolecularWeight: 424.66176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC1=CC=CC=C1C2=NC=NC=C2CCCCCCC

Isomeric SMILES

CCCCCCCCCCCOC1=CC=CC=C1C2=NC=NC=C2CCCCCCC

InChI

InChI=1S/C28H44N2O/c1-3-5-7-9-10-11-12-14-18-22-31-27-21-17-16-20-26(27)28-25(23-29-24-30-28)19-15-13-8-6-4-2/h16-17,20-21,23-24H,3-15,18-19,22H2,1-2H3