diethyl-[[2-[[(5-phenyl-1H-pyrazol-4-yl)carbonylamino]methyl]phenyl]methyl]azanium

Systemtic Name: diethyl-[[2-[[(5-phenyl-1H-pyrazol-4-yl)carbonylamino]methyl]phenyl]methyl]azanium Openeye Name: diethyl-[[2-[[(5-phenyl-1H-pyrazole-4-carbonyl)amino]methyl]phenyl]methyl]ammonium CAS Name: diethyl-[[2-[[[oxo-(5-phenyl-1H-pyrazol-4-yl)methyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: diethyl-[[2-[[(5-phenyl-1H-pyrazole-4-carbonyl)amino]methyl]phenyl]methyl]azanium Traditional Name: diethyl-[2-[[(5-phenyl-1H-pyrazole-4-carbonyl)amino]methyl]benzyl]ammonium Formula: C22H27N4O+ MolecularWeight: 363.47598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O/c1-3-26(4-2)16-19-13-9-8-12-18(19)14-23-22(27)20-15-24-25-21(20)17-10-6-5-7-11-17/h5-13,15H,3-4,14,16H2,1-2H3,(H,23,27)(H,24,25)/p+1