[(2R)-1-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]piperidin-1-ium-2-yl]methanol

Systemtic Name: [(2R)-1-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]piperidin-1-ium-2-yl]methanol Openeye Name: [(2R)-1-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]piperidin-1-ium-2-yl]methanol CAS Name: [(2R)-1-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]-2-piperidin-1-iumyl]methanol IUPAC Name: [(2R)-1-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]piperidin-1-ium-2-yl]methanol Traditional Name: [(2R)-1-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]piperidin-1-ium-2-yl]methanol Formula: C22H26N3O+ MolecularWeight: 348.46134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)CO)CC2=C(NN=C2)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC[NH+]([C@H](C1)CO)CC2=C(NN=C2)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H25N3O/c26-16-21-8-4-5-13-25(21)15-20-14-23-24-22(20)19-11-9-18(10-12-19)17-6-2-1-3-7-17/h1-3,6-7,9-12,14,21,26H,4-5,8,13,15-16H2,(H,23,24)/p+1/t21-/m1/s1