3-morpholin-4-ium-4-yl-1-[2-(trifluoromethyl)phenothiazin-10-yl]propan-1-one chloride

Systemtic Name: 3-morpholin-4-ium-4-yl-1-[2-(trifluoromethyl)phenothiazin-10-yl]propan-1-one chloride Openeye Name: 3-morpholin-4-ium-4-yl-1-[2-(trifluoromethyl)phenothiazin-10-yl]propan-1-one chloride CAS Name: 3-(4-morpholin-4-iumyl)-1-[2-(trifluoromethyl)-10-phenothiazinyl]-1-propanone chloride IUPAC Name: 3-morpholin-4-ium-4-yl-1-[2-(trifluoromethyl)phenothiazin-10-yl]propan-1-one chloride Traditional Name: 3-morpholin-4-ium-4-yl-1-[2-(trifluoromethyl)phenothiazin-10-yl]propan-1-one chloride Formula: C20H20ClF3N2O2S MolecularWeight: 444.89821

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCC(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F.[Cl-]

Isomeric SMILES

C1COCC[NH+]1CCC(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F.[Cl-]

InChI

InChI=1S/C20H19F3N2O2S.ClH/c21-20(22,23)14-5-6-18-16(13-14)25(15-3-1-2-4-17(15)28-18)19(26)7-8-24-9-11-27-12-10-24;/h1-6,13H,7-12H2;1H