1-[(1,3-diphenylpyrazol-4-yl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(1,3-diphenylpyrazol-4-yl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1,3-diphenylpyrazol-4-yl)methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(1,3-diphenyl-4-pyrazolyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(1,3-diphenylpyrazol-4-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(1,3-diphenylpyrazol-4-yl)methyl]piperidin-1-ium-4-carboxamide Formula: C22H25N4O+ MolecularWeight: 361.4601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1C(=O)N)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

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