diphenyl-[1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]methanol

Systemtic Name: diphenyl-[1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]methanol Openeye Name: diphenyl-[1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]methanol CAS Name: diphenyl-[1-[(5-phenyl-1H-pyrazol-4-yl)methyl]-4-piperidin-1-iumyl]methanol IUPAC Name: diphenyl-[1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]methanol Traditional Name: diphenyl-[1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]methanol Formula: C28H30N3O+ MolecularWeight: 424.5573

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(C2=CC=CC=C2)(C3=CC=CC=C3)O)CC4=C(NN=C4)C5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CCC1C(C2=CC=CC=C2)(C3=CC=CC=C3)O)CC4=C(NN=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H29N3O/c32-28(24-12-6-2-7-13-24,25-14-8-3-9-15-25)26-16-18-31(19-17-26)21-23-20-29-30-27(23)22-10-4-1-5-11-22/h1-15,20,26,32H,16-19,21H2,(H,29,30)/p+1