2-(1-methylpyrrolidin-1-ium-1-yl)-1-phenothiazin-10-yl-propan-1-one bromide

Systemtic Name: 2-(1-methylpyrrolidin-1-ium-1-yl)-1-phenothiazin-10-yl-propan-1-one bromide Openeye Name: 2-(1-methylpyrrolidin-1-ium-1-yl)-1-phenothiazin-10-yl-propan-1-one bromide CAS Name: 2-(1-methyl-1-pyrrolidin-1-iumyl)-1-(10-phenothiazinyl)-1-propanone bromide IUPAC Name: 2-(1-methylpyrrolidin-1-ium-1-yl)-1-phenothiazin-10-ylpropan-1-one bromide Traditional Name: 2-(1-methylpyrrolidin-1-ium-1-yl)-1-phenothiazin-10-yl-propan-1-one bromide Formula: C20H23BrN2OS MolecularWeight: 419.37842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)[N+]4(CCCC4)C.[Br-]

Isomeric SMILES

CC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)[N+]4(CCCC4)C.[Br-]

InChI

InChI=1S/C20H23N2OS.BrH/c1-15(22(2)13-7-8-14-22)20(23)21-16-9-3-5-11-18(16)24-19-12-6-4-10-17(19)21;/h3-6,9-12,15H,7-8,13-14H2,1-2H3;1H/q+1;/p-1