3-[3-[3-(2-cyanophenyl)phenyl]pyrazol-1-yl]propyl-dimethyl-azanium

Systemtic Name: 3-[3-[3-(2-cyanophenyl)phenyl]pyrazol-1-yl]propyl-dimethyl-azanium Openeye Name: 3-[3-[3-(2-cyanophenyl)phenyl]pyrazol-1-yl]propyl-dimethyl-ammonium CAS Name: 3-[3-[3-(2-cyanophenyl)phenyl]-1-pyrazolyl]propyl-dimethylammonium IUPAC Name: 3-[3-[3-(2-cyanophenyl)phenyl]pyrazol-1-yl]propyl-dimethylazanium Traditional Name: 3-[3-[3-(2-cyanophenyl)phenyl]pyrazol-1-yl]propyl-dimethyl-ammonium Formula: C21H23N4+ MolecularWeight: 331.43412

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN1C=CC(=N1)C2=CC=CC(=C2)C3=CC=CC=C3C#N

Isomeric SMILES

C[NH+](C)CCCN1C=CC(=N1)C2=CC=CC(=C2)C3=CC=CC=C3C#N

InChI

InChI=1S/C21H22N4/c1-24(2)12-6-13-25-14-11-21(23-25)18-9-5-8-17(15-18)20-10-4-3-7-19(20)16-22/h3-5,7-11,14-15H,6,12-13H2,1-2H3/p+1