1-[2-cyclohexyl-5-[(3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-yl]pyridin-1-ium

Systemtic Name: 1-[2-cyclohexyl-5-[(3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-yl]pyridin-1-ium Openeye Name: 1-[2-cyclohexyl-5-[(3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-yl]pyridin-1-ium CAS Name: 1-[2-cyclohexyl-5-[(3,5-dimethyl-1-pyrazolyl)methyl]-3-pyrazolyl]pyridin-1-ium IUPAC Name: 1-[2-cyclohexyl-5-[(3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-yl]pyridin-1-ium Traditional Name: 1-[2-cyclohexyl-5-[(3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-yl]pyridin-1-ium Formula: C20H26N5+ MolecularWeight: 336.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=NN(C(=C2)[N+]3=CC=CC=C3)C4CCCCC4)C

Isomeric SMILES

CC1=CC(=NN1CC2=NN(C(=C2)[N+]3=CC=CC=C3)C4CCCCC4)C

InChI

InChI=1S/C20H26N5/c1-16-13-17(2)24(21-16)15-18-14-20(23-11-7-4-8-12-23)25(22-18)19-9-5-3-6-10-19/h4,7-8,11-14,19H,3,5-6,9-10,15H2,1-2H3/q+1