2-[4-(1-heptyl-4-bicyclo[2.2.2]octanyl)phenyl]pyrimidine

Systemtic Name: 2-[4-(1-heptyl-4-bicyclo[2.2.2]octanyl)phenyl]pyrimidine Openeye Name: 2-[4-(1-heptyl-4-bicyclo[2.2.2]octanyl)phenyl]pyrimidine CAS Name: 2-[4-(1-heptyl-4-bicyclo[2.2.2]octanyl)phenyl]pyrimidine IUPAC Name: 2-[4-(1-heptyl-4-bicyclo[2.2.2]octanyl)phenyl]pyrimidine Traditional Name: 2-[4-(1-heptyl-4-bicyclo[2.2.2]octanyl)phenyl]pyrimidine Formula: C25H34N2 MolecularWeight: 362.55086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC12CCC(CC1)(CC2)C3=CC=C(C=C3)C4=NC=CC=N4

Isomeric SMILES

CCCCCCCC12CCC(CC1)(CC2)C3=CC=C(C=C3)C4=NC=CC=N4

InChI

InChI=1S/C25H34N2/c1-2-3-4-5-6-12-24-13-16-25(17-14-24,18-15-24)22-10-8-21(9-11-22)23-26-19-7-20-27-23/h7-11,19-20H,2-6,12-18H2,1H3