2-(4-chlorophenyl)-5-hept-1-ynyl-pyrimidine

Systemtic Name: 2-(4-chlorophenyl)-5-hept-1-ynyl-pyrimidine Openeye Name: 2-(4-chlorophenyl)-5-hept-1-ynyl-pyrimidine CAS Name: 2-(4-chlorophenyl)-5-hept-1-ynylpyrimidine IUPAC Name: 2-(4-chlorophenyl)-5-hept-1-ynylpyrimidine Traditional Name: 2-(4-chlorophenyl)-5-hept-1-ynyl-pyrimidine Formula: C17H17ClN2 MolecularWeight: 284.78328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CC1=CN=C(N=C1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCC#CC1=CN=C(N=C1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H17ClN2/c1-2-3-4-5-6-7-14-12-19-17(20-13-14)15-8-10-16(18)11-9-15/h8-13H,2-5H2,1H3