(3R)-1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[(5-phenyl-1H-pyrazol-4-yl)methyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-3-carboxamide Formula: C16H21N4O+ MolecularWeight: 285.36414

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=C(NN=C2)C3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1C[C@H](C[NH+](C1)CC2=C(NN=C2)C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C16H20N4O/c17-16(21)13-7-4-8-20(10-13)11-14-9-18-19-15(14)12-5-2-1-3-6-12/h1-3,5-6,9,13H,4,7-8,10-11H2,(H2,17,21)(H,18,19)/p+1/t13-/m1/s1