[2-[[[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]methyl]phenyl]methyl-diethyl-azanium

Systemtic Name: [2-[[[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]methyl]phenyl]methyl-diethyl-azanium Openeye Name: [2-[[(1-benzyl-5-chloro-3-methyl-pyrazole-4-carbonyl)amino]methyl]phenyl]methyl-diethyl-ammonium CAS Name: [2-[[[[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-oxomethyl]amino]methyl]phenyl]methyl-diethylammonium IUPAC Name: [2-[[(1-benzyl-5-chloro-3-methylpyrazole-4-carbonyl)amino]methyl]phenyl]methyl-diethylazanium Traditional Name: [2-[[(1-benzyl-5-chloro-3-methyl-pyrazole-4-carbonyl)amino]methyl]benzyl]-diethyl-ammonium Formula: C24H30ClN4O+ MolecularWeight: 425.9742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=CC=C1CNC(=O)C2=C(N(N=C2C)CC3=CC=CC=C3)Cl

Isomeric SMILES

CC[NH+](CC)CC1=CC=CC=C1CNC(=O)C2=C(N(N=C2C)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C24H29ClN4O/c1-4-28(5-2)17-21-14-10-9-13-20(21)15-26-24(30)22-18(3)27-29(23(22)25)16-19-11-7-6-8-12-19/h6-14H,4-5,15-17H2,1-3H3,(H,26,30)/p+1