2-(2,6-dimethylheptoxy)-5-nonyl-4-phenyl-pyrimidine

Systemtic Name: 2-(2,6-dimethylheptoxy)-5-nonyl-4-phenyl-pyrimidine Openeye Name: 2-(2,6-dimethylheptoxy)-5-nonyl-4-phenyl-pyrimidine CAS Name: 2-(2,6-dimethylheptoxy)-5-nonyl-4-phenylpyrimidine IUPAC Name: 2-(2,6-dimethylheptoxy)-5-nonyl-4-phenylpyrimidine Traditional Name: 2-(2,6-dimethylheptoxy)-5-nonyl-4-phenyl-pyrimidine Formula: C28H44N2O MolecularWeight: 424.66176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(N=C1C2=CC=CC=C2)OCC(C)CCCC(C)C

Isomeric SMILES

CCCCCCCCCC1=CN=C(N=C1C2=CC=CC=C2)OCC(C)CCCC(C)C

InChI

InChI=1S/C28H44N2O/c1-5-6-7-8-9-10-12-20-26-21-29-28(30-27(26)25-18-13-11-14-19-25)31-22-24(4)17-15-16-23(2)3/h11,13-14,18-19,21,23-24H,5-10,12,15-17,20,22H2,1-4H3