diethyl-methyl-(3-oxidanylidene-3-phenothiazin-10-yl-propyl)azanium bromide

Systemtic Name: diethyl-methyl-(3-oxidanylidene-3-phenothiazin-10-yl-propyl)azanium bromide Openeye Name: diethyl-methyl-(3-oxo-3-phenothiazin-10-yl-propyl)ammonium bromide CAS Name: diethyl-methyl-[3-oxo-3-(10-phenothiazinyl)propyl]ammonium bromide IUPAC Name: diethyl-methyl-(3-oxo-3-phenothiazin-10-ylpropyl)azanium bromide Traditional Name: diethyl-(3-keto-3-phenothiazin-10-yl-propyl)-methyl-ammonium bromide Formula: C20H25BrN2OS MolecularWeight: 421.3943

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CCC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31.[Br-]

Isomeric SMILES

CC[N+](C)(CC)CCC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31.[Br-]

InChI

InChI=1S/C20H25N2OS.BrH/c1-4-22(3,5-2)15-14-20(23)21-16-10-6-8-12-18(16)24-19-13-9-7-11-17(19)21;/h6-13H,4-5,14-15H2,1-3H3;1H/q+1;/p-1