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

Systemtic Name: 2-[4-(1-pentyl-4-bicyclo[2.2.2]octanyl)phenyl]pyrimidine Openeye Name: 2-[4-(1-pentyl-4-bicyclo[2.2.2]octanyl)phenyl]pyrimidine CAS Name: 2-[4-(1-pentyl-4-bicyclo[2.2.2]octanyl)phenyl]pyrimidine IUPAC Name: 2-[4-(1-pentyl-4-bicyclo[2.2.2]octanyl)phenyl]pyrimidine Traditional Name: 2-[4-(1-amyl-4-bicyclo[2.2.2]octanyl)phenyl]pyrimidine Formula: C23H30N2 MolecularWeight: 334.4977

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC12CCC(CC1)(CC2)C3=CC=C(C=C3)C4=NC=CC=N4

Isomeric SMILES

CCCCCC12CCC(CC1)(CC2)C3=CC=C(C=C3)C4=NC=CC=N4

InChI

InChI=1S/C23H30N2/c1-2-3-4-10-22-11-14-23(15-12-22,16-13-22)20-8-6-19(7-9-20)21-24-17-5-18-25-21/h5-9,17-18H,2-4,10-16H2,1H3