5-hexyl-4-(2-pentoxyphenyl)pyrimidine

Systemtic Name: 5-hexyl-4-(2-pentoxyphenyl)pyrimidine Openeye Name: 5-hexyl-4-(2-pentoxyphenyl)pyrimidine CAS Name: 5-hexyl-4-(2-pentoxyphenyl)pyrimidine IUPAC Name: 5-hexyl-4-(2-pentoxyphenyl)pyrimidine Traditional Name: 4-(2-amoxyphenyl)-5-hexyl-pyrimidine Formula: C21H30N2O MolecularWeight: 326.4757

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=CN=C1C2=CC=CC=C2OCCCCC

Isomeric SMILES

CCCCCCC1=CN=CN=C1C2=CC=CC=C2OCCCCC

InChI

InChI=1S/C21H30N2O/c1-3-5-7-8-12-18-16-22-17-23-21(18)19-13-9-10-14-20(19)24-15-11-6-4-2/h9-10,13-14,16-17H,3-8,11-12,15H2,1-2H3