3-hexyl-6-[2-(4-propoxyphenyl)ethynyl]pyridazine

Systemtic Name: 3-hexyl-6-[2-(4-propoxyphenyl)ethynyl]pyridazine Openeye Name: 3-hexyl-6-[2-(4-propoxyphenyl)ethynyl]pyridazine CAS Name: 3-hexyl-6-[2-(4-propoxyphenyl)ethynyl]pyridazine IUPAC Name: 3-hexyl-6-[2-(4-propoxyphenyl)ethynyl]pyridazine Traditional Name: 3-hexyl-6-[2-(4-propoxyphenyl)ethynyl]pyridazine Formula: C21H26N2O MolecularWeight: 322.44394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=NN=C(C=C1)C#CC2=CC=C(C=C2)OCCC

Isomeric SMILES

CCCCCCC1=NN=C(C=C1)C#CC2=CC=C(C=C2)OCCC

InChI

InChI=1S/C21H26N2O/c1-3-5-6-7-8-19-13-14-20(23-22-19)12-9-18-10-15-21(16-11-18)24-17-4-2/h10-11,13-16H,3-8,17H2,1-2H3