2-[butyl-[2-[(2-chloranyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl]amino]ethyl-diethyl-azanium chloride

Systemtic Name: 2-[butyl-[2-[(2-chloranyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl]amino]ethyl-diethyl-azanium chloride Openeye Name: 2-[butyl-[2-(2-chloro-6-methyl-anilino)-2-oxo-ethyl]amino]ethyl-diethyl-ammonium chloride CAS Name: 2-[butyl-[2-(2-chloro-6-methylanilino)-2-oxoethyl]amino]ethyl-diethylammonium chloride IUPAC Name: 2-[butyl-[2-(2-chloro-6-methylanilino)-2-oxoethyl]amino]ethyl-diethylazanium chloride Traditional Name: 2-[butyl-[2-(2-chloro-6-methyl-anilino)-2-keto-ethyl]amino]ethyl-diethyl-ammonium chloride Formula: C19H33Cl2N3O MolecularWeight: 390.39082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC[NH+](CC)CC)CC(=O)NC1=C(C=CC=C1Cl)C.[Cl-]

Isomeric SMILES

CCCCN(CC[NH+](CC)CC)CC(=O)NC1=C(C=CC=C1Cl)C.[Cl-]

InChI

InChI=1S/C19H32ClN3O.ClH/c1-5-8-12-23(14-13-22(6-2)7-3)15-18(24)21-19-16(4)10-9-11-17(19)20;/h9-11H,5-8,12-15H2,1-4H3,(H,21,24);1H