4-phenyl-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzamide

Systemtic Name: 4-phenyl-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzamide Openeye Name: 4-phenyl-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzamide CAS Name: 4-phenyl-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzamide IUPAC Name: 4-phenyl-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzamide Traditional Name: 4-phenyl-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzamide Formula: C20H22N3O+ MolecularWeight: 320.40818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=N[N+](=C(C1CNC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C)C

Isomeric SMILES

CC1=N[N+](=C(C1CNC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C)C

InChI

InChI=1S/C20H21N3O/c1-14-19(15(2)23(3)22-14)13-21-20(24)18-11-9-17(10-12-18)16-7-5-4-6-8-16/h4-12,19H,13H2,1-3H3/p+1