[4-[[(4-chloranyl-2-nitro-phenyl)carbonylamino]methyl]phenyl]methyl-diethyl-azanium

Systemtic Name: [4-[[(4-chloranyl-2-nitro-phenyl)carbonylamino]methyl]phenyl]methyl-diethyl-azanium Openeye Name: [4-[[(4-chloro-2-nitro-benzoyl)amino]methyl]phenyl]methyl-diethyl-ammonium CAS Name: [4-[[[(4-chloro-2-nitrophenyl)-oxomethyl]amino]methyl]phenyl]methyl-diethylammonium IUPAC Name: [4-[[(4-chloro-2-nitrobenzoyl)amino]methyl]phenyl]methyl-diethylazanium Traditional Name: [4-[[(4-chloro-2-nitro-benzoyl)amino]methyl]benzyl]-diethyl-ammonium Formula: C19H23ClN3O3+ MolecularWeight: 376.85722

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H22ClN3O3/c1-3-22(4-2)13-15-7-5-14(6-8-15)12-21-19(24)17-10-9-16(20)11-18(17)23(25)26/h5-11H,3-4,12-13H2,1-2H3,(H,21,24)/p+1