1-(2-chloranylphenothiazin-10-yl)-2-pyrrolidin-1-ium-1-yl-ethanone chloride

Systemtic Name: 1-(2-chloranylphenothiazin-10-yl)-2-pyrrolidin-1-ium-1-yl-ethanone chloride Openeye Name: 1-(2-chlorophenothiazin-10-yl)-2-pyrrolidin-1-ium-1-yl-ethanone chloride CAS Name: 1-(2-chloro-10-phenothiazinyl)-2-(1-pyrrolidin-1-iumyl)ethanone chloride IUPAC Name: 1-(2-chlorophenothiazin-10-yl)-2-pyrrolidin-1-ium-1-ylethanone chloride Traditional Name: 1-(2-chlorophenothiazin-10-yl)-2-pyrrolidin-1-ium-1-yl-ethanone chloride Formula: C18H18Cl2N2OS MolecularWeight: 381.31932

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl.[Cl-]

Isomeric SMILES

C1CC[NH+](C1)CC(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl.[Cl-]

InChI

InChI=1S/C18H17ClN2OS.ClH/c19-13-7-8-17-15(11-13)21(14-5-1-2-6-16(14)23-17)18(22)12-20-9-3-4-10-20;/h1-2,5-8,11H,3-4,9-10,12H2;1H