4-(4-cyclopropyl-1,2,3-triazol-1-yl)-1-[(2-phenylpyrazol-3-yl)methyl]piperidin-1-ium

Systemtic Name: 4-(4-cyclopropyl-1,2,3-triazol-1-yl)-1-[(2-phenylpyrazol-3-yl)methyl]piperidin-1-ium Openeye Name: 4-(4-cyclopropyltriazol-1-yl)-1-[(2-phenylpyrazol-3-yl)methyl]piperidin-1-ium CAS Name: 4-(4-cyclopropyl-1-triazolyl)-1-[(2-phenyl-3-pyrazolyl)methyl]piperidin-1-ium IUPAC Name: 4-(4-cyclopropyltriazol-1-yl)-1-[(2-phenylpyrazol-3-yl)methyl]piperidin-1-ium Traditional Name: 4-(4-cyclopropyltriazol-1-yl)-1-[(2-phenylpyrazol-3-yl)methyl]piperidin-1-ium Formula: C20H25N6+ MolecularWeight: 349.4527

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CN(N=N2)C3CC[NH+](CC3)CC4=CC=NN4C5=CC=CC=C5

Isomeric SMILES

C1CC1C2=CN(N=N2)C3CC[NH+](CC3)CC4=CC=NN4C5=CC=CC=C5

InChI

InChI=1S/C20H24N6/c1-2-4-18(5-3-1)26-19(8-11-21-26)14-24-12-9-17(10-13-24)25-15-20(22-23-25)16-6-7-16/h1-5,8,11,15-17H,6-7,9-10,12-14H2/p+1