5-[4-[6-(4-butoxyphenyl)pyridazin-3-yl]phenyl]pentanenitrile

Systemtic Name: 5-[4-[6-(4-butoxyphenyl)pyridazin-3-yl]phenyl]pentanenitrile Openeye Name: 5-[4-[6-(4-butoxyphenyl)pyridazin-3-yl]phenyl]pentanenitrile CAS Name: 5-[4-[6-(4-butoxyphenyl)-3-pyridazinyl]phenyl]pentanenitrile IUPAC Name: 5-[4-[6-(4-butoxyphenyl)pyridazin-3-yl]phenyl]pentanenitrile Traditional Name: 5-[4-[6-(4-butoxyphenyl)pyridazin-3-yl]phenyl]valeronitrile Formula: C25H27N3O MolecularWeight: 385.50138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NN=C(C=C2)C3=CC=C(C=C3)CCCCC#N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NN=C(C=C2)C3=CC=C(C=C3)CCCCC#N

InChI

InChI=1S/C25H27N3O/c1-2-3-19-29-23-14-12-22(13-15-23)25-17-16-24(27-28-25)21-10-8-20(9-11-21)7-5-4-6-18-26/h8-17H,2-7,19H2,1H3