5-(8-cyclopentyloctoxy)-2-(4-octylphenyl)pyrimidine

Systemtic Name: 5-(8-cyclopentyloctoxy)-2-(4-octylphenyl)pyrimidine Openeye Name: 5-(8-cyclopentyloctoxy)-2-(4-octylphenyl)pyrimidine CAS Name: 5-(8-cyclopentyloctoxy)-2-(4-octylphenyl)pyrimidine IUPAC Name: 5-(8-cyclopentyloctoxy)-2-(4-octylphenyl)pyrimidine Traditional Name: 5-(8-cyclopentyloctoxy)-2-(4-octylphenyl)pyrimidine Formula: C31H48N2O MolecularWeight: 464.72562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCCCCCCCC3CCCC3

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCCCCCCCC3CCCC3

InChI

InChI=1S/C31H48N2O/c1-2-3-4-5-8-12-17-28-20-22-29(23-21-28)31-32-25-30(26-33-31)34-24-15-10-7-6-9-11-16-27-18-13-14-19-27/h20-23,25-27H,2-19,24H2,1H3