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

Systemtic Name: 4-(phenylmethyl)-1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium Openeye Name: 4-benzyl-1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium CAS Name: 4-(phenylmethyl)-1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium IUPAC Name: 4-benzyl-1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium Traditional Name: 4-benzyl-1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium Formula: C22H26N3+ MolecularWeight: 332.46194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC2=CC=CC=C2)CC3=C(NN=C3)C4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1CC2=CC=CC=C2)CC3=C(NN=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H25N3/c1-3-7-18(8-4-1)15-19-11-13-25(14-12-19)17-21-16-23-24-22(21)20-9-5-2-6-10-20/h1-10,16,19H,11-15,17H2,(H,23,24)/p+1