2-heptyl-4-(2-nonoxyphenyl)pyrimidine

Systemtic Name: 2-heptyl-4-(2-nonoxyphenyl)pyrimidine Openeye Name: 2-heptyl-4-(2-nonoxyphenyl)pyrimidine CAS Name: 2-heptyl-4-(2-nonoxyphenyl)pyrimidine IUPAC Name: 2-heptyl-4-(2-nonoxyphenyl)pyrimidine Traditional Name: 2-heptyl-4-(2-nonoxyphenyl)pyrimidine Formula: C26H40N2O MolecularWeight: 396.6086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC=CC=C1C2=NC(=NC=C2)CCCCCCC

Isomeric SMILES

CCCCCCCCCOC1=CC=CC=C1C2=NC(=NC=C2)CCCCCCC

InChI

InChI=1S/C26H40N2O/c1-3-5-7-9-10-12-16-22-29-25-18-15-14-17-23(25)24-20-21-27-26(28-24)19-13-11-8-6-4-2/h14-15,17-18,20-21H,3-13,16,19,22H2,1-2H3