2-(3-azanyl-4-chloranyl-phenyl)carbonyloxyethyl-diethyl-azanium chloride

Systemtic Name: 2-(3-azanyl-4-chloranyl-phenyl)carbonyloxyethyl-diethyl-azanium chloride Openeye Name: 2-(3-amino-4-chloro-benzoyl)oxyethyl-diethyl-ammonium chloride CAS Name: 2-[(3-amino-4-chlorophenyl)-oxomethoxy]ethyl-diethylammonium chloride IUPAC Name: 2-(3-amino-4-chlorobenzoyl)oxyethyl-diethylazanium chloride Traditional Name: 2-(3-amino-4-chloro-benzoyl)oxyethyl-diethyl-ammonium chloride Formula: C13H20Cl2N2O2 MolecularWeight: 307.2161

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC(=O)C1=CC(=C(C=C1)Cl)N.[Cl-]

Isomeric SMILES

CC[NH+](CC)CCOC(=O)C1=CC(=C(C=C1)Cl)N.[Cl-]

InChI

InChI=1S/C13H19ClN2O2.ClH/c1-3-16(4-2)7-8-18-13(17)10-5-6-11(14)12(15)9-10;/h5-6,9H,3-4,7-8,15H2,1-2H3;1H