2-(3-cyclohexyl-2-oxidanylidene-1-benzofuran-3-yl)ethyl-diethyl-azanium chloride

Systemtic Name: 2-(3-cyclohexyl-2-oxidanylidene-1-benzofuran-3-yl)ethyl-diethyl-azanium chloride Openeye Name: 2-(3-cyclohexyl-2-oxo-benzofuran-3-yl)ethyl-diethyl-ammonium chloride CAS Name: 2-(3-cyclohexyl-2-oxo-3-benzofuranyl)ethyl-diethylammonium chloride IUPAC Name: 2-(3-cyclohexyl-2-oxo-1-benzofuran-3-yl)ethyl-diethylazanium chloride Traditional Name: 2-(3-cyclohexyl-2-keto-coumaran-3-yl)ethyl-diethyl-ammonium chloride Formula: C20H30ClNO2 MolecularWeight: 351.9107

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC1(C2=CC=CC=C2OC1=O)C3CCCCC3.[Cl-]

Isomeric SMILES

CC[NH+](CC)CCC1(C2=CC=CC=C2OC1=O)C3CCCCC3.[Cl-]

InChI

InChI=1S/C20H29NO2.ClH/c1-3-21(4-2)15-14-20(16-10-6-5-7-11-16)17-12-8-9-13-18(17)23-19(20)22;/h8-9,12-13,16H,3-7,10-11,14-15H2,1-2H3;1H