5-(5-methylheptyl)-2-(4-octoxyphenyl)pyrimidine

Systemtic Name: 5-(5-methylheptyl)-2-(4-octoxyphenyl)pyrimidine Openeye Name: 5-(5-methylheptyl)-2-(4-octoxyphenyl)pyrimidine CAS Name: 5-(5-methylheptyl)-2-(4-octoxyphenyl)pyrimidine IUPAC Name: 5-(5-methylheptyl)-2-(4-octoxyphenyl)pyrimidine Traditional Name: 5-(5-methylheptyl)-2-(4-octoxyphenyl)pyrimidine Formula: C26H40N2O MolecularWeight: 396.6086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)CCCCC(C)CC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)CCCCC(C)CC

InChI

InChI=1S/C26H40N2O/c1-4-6-7-8-9-12-19-29-25-17-15-24(16-18-25)26-27-20-23(21-28-26)14-11-10-13-22(3)5-2/h15-18,20-22H,4-14,19H2,1-3H3