diethyl-[[2-[[(4-pyrazol-1-ylphenyl)carbonylamino]methyl]phenyl]methyl]azanium

Systemtic Name: diethyl-[[2-[[(4-pyrazol-1-ylphenyl)carbonylamino]methyl]phenyl]methyl]azanium Openeye Name: diethyl-[[2-[[(4-pyrazol-1-ylbenzoyl)amino]methyl]phenyl]methyl]ammonium CAS Name: diethyl-[[2-[[[oxo-[4-(1-pyrazolyl)phenyl]methyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: diethyl-[[2-[[(4-pyrazol-1-ylbenzoyl)amino]methyl]phenyl]methyl]azanium Traditional Name: diethyl-[2-[[(4-pyrazol-1-ylbenzoyl)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=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CC[NH+](CC)CC1=CC=CC=C1CNC(=O)C2=CC=C(C=C2)N3C=CC=N3

InChI

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