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

Systemtic Name: 3-[2-(4-butoxyphenyl)ethynyl]-6-chloranyl-pyridazine Openeye Name: 3-[2-(4-butoxyphenyl)ethynyl]-6-chloro-pyridazine CAS Name: 3-[2-(4-butoxyphenyl)ethynyl]-6-chloropyridazine IUPAC Name: 3-[2-(4-butoxyphenyl)ethynyl]-6-chloropyridazine Traditional Name: 3-[2-(4-butoxyphenyl)ethynyl]-6-chloro-pyridazine Formula: C16H15ClN2O MolecularWeight: 286.7561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C#CC2=NN=C(C=C2)Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C#CC2=NN=C(C=C2)Cl

InChI

InChI=1S/C16H15ClN2O/c1-2-3-12-20-15-9-5-13(6-10-15)4-7-14-8-11-16(17)19-18-14/h5-6,8-11H,2-3,12H2,1H3