5-chloranyl-2-[2-(4-hexylphenyl)ethynyl]pyrimidine

Systemtic Name: 5-chloranyl-2-[2-(4-hexylphenyl)ethynyl]pyrimidine Openeye Name: 5-chloro-2-[2-(4-hexylphenyl)ethynyl]pyrimidine CAS Name: 5-chloro-2-[2-(4-hexylphenyl)ethynyl]pyrimidine IUPAC Name: 5-chloro-2-[2-(4-hexylphenyl)ethynyl]pyrimidine Traditional Name: 5-chloro-2-[2-(4-hexylphenyl)ethynyl]pyrimidine Formula: C18H19ClN2 MolecularWeight: 298.80986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C#CC2=NC=C(C=N2)Cl

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C#CC2=NC=C(C=N2)Cl

InChI

InChI=1S/C18H19ClN2/c1-2-3-4-5-6-15-7-9-16(10-8-15)11-12-18-20-13-17(19)14-21-18/h7-10,13-14H,2-6H2,1H3