3-[2-(4-butoxyphenyl)ethynyl]-6-butyl-pyridazine

Systemtic Name: 3-[2-(4-butoxyphenyl)ethynyl]-6-butyl-pyridazine Openeye Name: 3-[2-(4-butoxyphenyl)ethynyl]-6-butyl-pyridazine CAS Name: 3-[2-(4-butoxyphenyl)ethynyl]-6-butylpyridazine IUPAC Name: 3-[2-(4-butoxyphenyl)ethynyl]-6-butylpyridazine Traditional Name: 3-[2-(4-butoxyphenyl)ethynyl]-6-butyl-pyridazine Formula: C20H24N2O MolecularWeight: 308.41736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(C=C1)C#CC2=CC=C(C=C2)OCCCC

Isomeric SMILES

CCCCC1=NN=C(C=C1)C#CC2=CC=C(C=C2)OCCCC

InChI

InChI=1S/C20H24N2O/c1-3-5-7-18-12-13-19(22-21-18)11-8-17-9-14-20(15-10-17)23-16-6-4-2/h9-10,12-15H,3-7,16H2,1-2H3