2-(4-bromophenyl)-5-undecoxy-pyrimidine

Systemtic Name: 2-(4-bromophenyl)-5-undecoxy-pyrimidine Openeye Name: 2-(4-bromophenyl)-5-undecoxy-pyrimidine CAS Name: 2-(4-bromophenyl)-5-undecoxypyrimidine IUPAC Name: 2-(4-bromophenyl)-5-undecoxypyrimidine Traditional Name: 2-(4-bromophenyl)-5-undecoxy-pyrimidine Formula: C21H29BrN2O MolecularWeight: 405.37176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)Br

InChI

InChI=1S/C21H29BrN2O/c1-2-3-4-5-6-7-8-9-10-15-25-20-16-23-21(24-17-20)18-11-13-19(22)14-12-18/h11-14,16-17H,2-10,15H2,1H3