3-(1-methylpyrrolidin-1-ium-1-yl)-1-phenothiazin-10-yl-propan-1-one bromide

Systemtic Name: 3-(1-methylpyrrolidin-1-ium-1-yl)-1-phenothiazin-10-yl-propan-1-one bromide Openeye Name: 3-(1-methylpyrrolidin-1-ium-1-yl)-1-phenothiazin-10-yl-propan-1-one bromide CAS Name: 3-(1-methyl-1-pyrrolidin-1-iumyl)-1-(10-phenothiazinyl)-1-propanone bromide IUPAC Name: 3-(1-methylpyrrolidin-1-ium-1-yl)-1-phenothiazin-10-ylpropan-1-one bromide Traditional Name: 3-(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:

C[N+]1(CCCC1)CCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42.[Br-]

Isomeric SMILES

C[N+]1(CCCC1)CCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42.[Br-]

InChI

InChI=1S/C20H23N2OS.BrH/c1-22(13-6-7-14-22)15-12-20(23)21-16-8-2-4-10-18(16)24-19-11-5-3-9-17(19)21;/h2-5,8-11H,6-7,12-15H2,1H3;1H/q+1;/p-1