2-[4-[2-[6-(4-pentylphenyl)pyridazin-3-yl]ethyl]cyclohexyl]ethanenitrile

Systemtic Name: 2-[4-[2-[6-(4-pentylphenyl)pyridazin-3-yl]ethyl]cyclohexyl]ethanenitrile Openeye Name: 2-[4-[2-[6-(4-pentylphenyl)pyridazin-3-yl]ethyl]cyclohexyl]acetonitrile CAS Name: 2-[4-[2-[6-(4-pentylphenyl)-3-pyridazinyl]ethyl]cyclohexyl]acetonitrile IUPAC Name: 2-[4-[2-[6-(4-pentylphenyl)pyridazin-3-yl]ethyl]cyclohexyl]acetonitrile Traditional Name: 2-[4-[2-[6-(4-amylphenyl)pyridazin-3-yl]ethyl]cyclohexyl]acetonitrile Formula: C25H33N3 MolecularWeight: 375.54962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=NN=C(C=C2)CCC3CCC(CC3)CC#N

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=NN=C(C=C2)CCC3CCC(CC3)CC#N

InChI

InChI=1S/C25H33N3/c1-2-3-4-5-20-10-13-23(14-11-20)25-17-16-24(27-28-25)15-12-21-6-8-22(9-7-21)18-19-26/h10-11,13-14,16-17,21-22H,2-9,12,15,18H2,1H3