2,6-dibutyl-4-phenyl-1-(1H-pyrazol-5-yl)pyridin-1-ium

Systemtic Name: 2,6-dibutyl-4-phenyl-1-(1H-pyrazol-5-yl)pyridin-1-ium Openeye Name: 2,6-dibutyl-4-phenyl-1-(1H-pyrazol-5-yl)pyridin-1-ium CAS Name: 2,6-dibutyl-4-phenyl-1-(1H-pyrazol-5-yl)pyridin-1-ium IUPAC Name: 2,6-dibutyl-4-phenyl-1-(1H-pyrazol-5-yl)pyridin-1-ium Traditional Name: 2,6-dibutyl-4-phenyl-1-(1H-pyrazol-5-yl)pyridin-1-ium Formula: C22H28N3+ MolecularWeight: 334.47782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=CC(=[N+]1C2=CC=NN2)CCCC)C3=CC=CC=C3

Isomeric SMILES

CCCCC1=CC(=CC(=[N+]1C2=CC=NN2)CCCC)C3=CC=CC=C3

InChI

InChI=1S/C22H28N3/c1-3-5-12-20-16-19(18-10-8-7-9-11-18)17-21(13-6-4-2)25(20)22-14-15-23-24-22/h7-11,14-17H,3-6,12-13H2,1-2H3,(H,23,24)/q+1