1-[(1-phenylpyrazol-4-yl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(1-phenylpyrazol-4-yl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1-phenylpyrazol-4-yl)methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(1-phenyl-4-pyrazolyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(1-phenylpyrazol-4-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(1-phenylpyrazol-4-yl)methyl]piperidin-1-ium-4-carboxamide Formula: C16H21N4O+ MolecularWeight: 285.36414

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N)CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1C(=O)N)CC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C16H20N4O/c17-16(21)14-6-8-19(9-7-14)11-13-10-18-20(12-13)15-4-2-1-3-5-15/h1-5,10,12,14H,6-9,11H2,(H2,17,21)/p+1