2-[[(E)-but-2-enoyl]-(2,6-dimethylphenyl)amino]ethyl-diethyl-azanium chloride

Systemtic Name: 2-[[(E)-but-2-enoyl]-(2,6-dimethylphenyl)amino]ethyl-diethyl-azanium chloride Openeye Name: 2-(N-[(E)-but-2-enoyl]-2,6-dimethyl-anilino)ethyl-diethyl-ammonium chloride CAS Name: 2-(2,6-dimethyl-N-[(E)-1-oxobut-2-enyl]anilino)ethyl-diethylammonium chloride IUPAC Name: 2-(N-[(E)-but-2-enoyl]-2,6-dimethylanilino)ethyl-diethylazanium chloride Traditional Name: 2-(N-[(E)-but-2-enoyl]-2,6-dimethyl-anilino)ethyl-diethyl-ammonium chloride Formula: C18H29ClN2O MolecularWeight: 324.88866

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(C1=C(C=CC=C1C)C)C(=O)C=CC.[Cl-]

Isomeric SMILES

CC[NH+](CC)CCN(C1=C(C=CC=C1C)C)C(=O)/C=C/C.[Cl-]

InChI

InChI=1S/C18H28N2O.ClH/c1-6-10-17(21)20(14-13-19(7-2)8-3)18-15(4)11-9-12-16(18)5;/h6,9-12H,7-8,13-14H2,1-5H3;1H/b10-6+;