diethyl-(5-oxidanylidene-3,4-dihydro-2H-1-benzothiepin-4-yl)azanium chloride

Systemtic Name: diethyl-(5-oxidanylidene-3,4-dihydro-2H-1-benzothiepin-4-yl)azanium chloride Openeye Name: diethyl-(5-oxo-3,4-dihydro-2H-1-benzothiepin-4-yl)ammonium chloride CAS Name: diethyl-(5-oxo-3,4-dihydro-2H-1-benzothiepin-4-yl)ammonium chloride IUPAC Name: diethyl-(5-oxo-3,4-dihydro-2H-1-benzothiepin-4-yl)azanium chloride Traditional Name: diethyl-(5-keto-3,4-dihydro-2H-1-benzothiepin-4-yl)ammonium chloride Formula: C14H20ClNOS MolecularWeight: 285.8327

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C1CCSC2=CC=CC=C2C1=O.[Cl-]

Isomeric SMILES

CC[NH+](CC)C1CCSC2=CC=CC=C2C1=O.[Cl-]

InChI

InChI=1S/C14H19NOS.ClH/c1-3-15(4-2)12-9-10-17-13-8-6-5-7-11(13)14(12)16;/h5-8,12H,3-4,9-10H2,1-2H3;1H