5-butoxy-2-(4-hexylphenyl)pyrimidine

Systemtic Name: 5-butoxy-2-(4-hexylphenyl)pyrimidine Openeye Name: 5-butoxy-2-(4-hexylphenyl)pyrimidine CAS Name: 5-butoxy-2-(4-hexylphenyl)pyrimidine IUPAC Name: 5-butoxy-2-(4-hexylphenyl)pyrimidine Traditional Name: 5-butoxy-2-(4-hexylphenyl)pyrimidine Formula: C20H28N2O MolecularWeight: 312.44912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCCC

InChI

InChI=1S/C20H28N2O/c1-3-5-7-8-9-17-10-12-18(13-11-17)20-21-15-19(16-22-20)23-14-6-4-2/h10-13,15-16H,3-9,14H2,1-2H3