(1-cyclohexylpyrazol-4-yl)methyl-[3-(dimethylazaniumyl)propyl]-(pyridin-2-ylmethyl)azanium

Systemtic Name: (1-cyclohexylpyrazol-4-yl)methyl-[3-(dimethylazaniumyl)propyl]-(pyridin-2-ylmethyl)azanium Openeye Name: (1-cyclohexylpyrazol-4-yl)methyl-[3-(dimethylammonio)propyl]-(2-pyridylmethyl)ammonium CAS Name: (1-cyclohexyl-4-pyrazolyl)methyl-[3-(dimethylammonio)propyl]-(2-pyridinylmethyl)ammonium IUPAC Name: (1-cyclohexylpyrazol-4-yl)methyl-[3-(dimethylazaniumyl)propyl]-(pyridin-2-ylmethyl)azanium Traditional Name: (1-cyclohexylpyrazol-4-yl)methyl-[3-(dimethylammonio)propyl]-(2-pyridylmethyl)ammonium Formula: C21H35N5+2 MolecularWeight: 357.5361

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC[NH+](CC1=CC=CC=N1)CC2=CN(N=C2)C3CCCCC3

Isomeric SMILES

C[NH+](C)CCC[NH+](CC1=CC=CC=N1)CC2=CN(N=C2)C3CCCCC3

InChI

InChI=1S/C21H33N5/c1-24(2)13-8-14-25(18-20-9-6-7-12-22-20)16-19-15-23-26(17-19)21-10-4-3-5-11-21/h6-7,9,12,15,17,21H,3-5,8,10-11,13-14,16,18H2,1-2H3/p+2