5-[3-methyl-4-[2-(4-propylcyclohexyl)ethyl]phenyl]-2-nonyl-pyrimidine

Systemtic Name: 5-[3-methyl-4-[2-(4-propylcyclohexyl)ethyl]phenyl]-2-nonyl-pyrimidine Openeye Name: 5-[3-methyl-4-[2-(4-propylcyclohexyl)ethyl]phenyl]-2-nonyl-pyrimidine CAS Name: 5-[3-methyl-4-[2-(4-propylcyclohexyl)ethyl]phenyl]-2-nonylpyrimidine IUPAC Name: 5-[3-methyl-4-[2-(4-propylcyclohexyl)ethyl]phenyl]-2-nonylpyrimidine Traditional Name: 5-[3-methyl-4-[2-(4-propylcyclohexyl)ethyl]phenyl]-2-nonyl-pyrimidine Formula: C31H48N2 MolecularWeight: 448.72622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=NC=C(C=N1)C2=CC(=C(C=C2)CCC3CCC(CC3)CCC)C

Isomeric SMILES

CCCCCCCCCC1=NC=C(C=N1)C2=CC(=C(C=C2)CCC3CCC(CC3)CCC)C

InChI

InChI=1S/C31H48N2/c1-4-6-7-8-9-10-11-13-31-32-23-30(24-33-31)29-21-20-28(25(3)22-29)19-18-27-16-14-26(12-5-2)15-17-27/h20-24,26-27H,4-19H2,1-3H3