[4-[[(3-chloranyl-4,5-dimethoxy-phenyl)carbonylamino]methyl]phenyl]methyl-diethyl-azanium

Systemtic Name: [4-[[(3-chloranyl-4,5-dimethoxy-phenyl)carbonylamino]methyl]phenyl]methyl-diethyl-azanium Openeye Name: [4-[[(3-chloro-4,5-dimethoxy-benzoyl)amino]methyl]phenyl]methyl-diethyl-ammonium CAS Name: [4-[[[(3-chloro-4,5-dimethoxyphenyl)-oxomethyl]amino]methyl]phenyl]methyl-diethylammonium IUPAC Name: [4-[[(3-chloro-4,5-dimethoxybenzoyl)amino]methyl]phenyl]methyl-diethylazanium Traditional Name: [4-[[(3-chloro-4,5-dimethoxy-benzoyl)amino]methyl]benzyl]-diethyl-ammonium Formula: C21H28ClN2O3+ MolecularWeight: 391.91162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27ClN2O3/c1-5-24(6-2)14-16-9-7-15(8-10-16)13-23-21(25)17-11-18(22)20(27-4)19(12-17)26-3/h7-12H,5-6,13-14H2,1-4H3,(H,23,25)/p+1