diethyl-[3-oxidanylidene-3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]azanium chloride

Systemtic Name: diethyl-[3-oxidanylidene-3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]azanium chloride Openeye Name: diethyl-[3-oxo-3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]ammonium chloride CAS Name: diethyl-[3-oxo-3-[2-(trifluoromethyl)-10-phenothiazinyl]propyl]ammonium chloride IUPAC Name: diethyl-[3-oxo-3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]azanium chloride Traditional Name: diethyl-[3-keto-3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]ammonium chloride Formula: C20H22ClF3N2OS MolecularWeight: 430.91469

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC(=O)N1C2=CC=CC=C2SC3=C1C=C(C=C3)C(F)(F)F.[Cl-]

Isomeric SMILES

CC[NH+](CC)CCC(=O)N1C2=CC=CC=C2SC3=C1C=C(C=C3)C(F)(F)F.[Cl-]

InChI

InChI=1S/C20H21F3N2OS.ClH/c1-3-24(4-2)12-11-19(26)25-15-7-5-6-8-17(15)27-18-10-9-14(13-16(18)25)20(21,22)23;/h5-10,13H,3-4,11-12H2,1-2H3;1H