1-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]piperidin-1-ium-4-carboxamide Formula: C22H25N4O+ MolecularWeight: 361.4601

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N)CC2=C(NN=C2)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1C(=O)N)CC2=C(NN=C2)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4O/c23-22(27)19-10-12-26(13-11-19)15-20-14-24-25-21(20)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,14,19H,10-13,15H2,(H2,23,27)(H,24,25)/p+1