ethyl-[2-(4-oxidanyl-9-oxidanylidene-thioxanthen-1-yl)oxyethyl]azanium dichloride

Systemtic Name: ethyl-[2-(4-oxidanyl-9-oxidanylidene-thioxanthen-1-yl)oxyethyl]azanium dichloride Openeye Name: ethyl-[2-(4-hydroxy-9-oxo-thioxanthen-1-yl)oxyethyl]ammonium dichloride CAS Name: ethyl-[2-[(4-hydroxy-9-oxo-1-thioxanthenyl)oxy]ethyl]ammonium dichloride IUPAC Name: ethyl-[2-(4-hydroxy-9-oxothioxanthen-1-yl)oxyethyl]azanium dichloride Traditional Name: ethyl-[2-(4-hydroxy-9-keto-thioxanthen-1-yl)oxyethyl]ammonium dichloride Formula: C17H18Cl2NO3S- MolecularWeight: 387.30072

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]CCOC1=C2C(=C(C=C1)O)SC3=CC=CC=C3C2=O.[Cl-].[Cl-]

Isomeric SMILES

CC[NH2+]CCOC1=C2C(=C(C=C1)O)SC3=CC=CC=C3C2=O.[Cl-].[Cl-]

InChI

InChI=1S/C17H17NO3S.2ClH/c1-2-18-9-10-21-13-8-7-12(19)17-15(13)16(20)11-5-3-4-6-14(11)22-17;;/h3-8,18-19H,2,9-10H2,1H3;2*1H/p-1