[C-[[5-bromanyl-2-(2-ethoxy-2-oxidanylidene-ethoxy)phenyl]methylsulfanyl]carbonimidoyl]azanium chloride

Systemtic Name: [C-[[5-bromanyl-2-(2-ethoxy-2-oxidanylidene-ethoxy)phenyl]methylsulfanyl]carbonimidoyl]azanium chloride Openeye Name: [[5-bromo-2-(2-ethoxy-2-oxo-ethoxy)phenyl]methylsulfanylcarbonimidoyl]ammonium chloride CAS Name: [[[5-bromo-2-(2-ethoxy-2-oxoethoxy)phenyl]methylthio]-iminomethyl]ammonium chloride IUPAC Name: [C-[[5-bromo-2-(2-ethoxy-2-oxoethoxy)phenyl]methylsulfanyl]carbonimidoyl]azanium chloride Traditional Name: [[[5-bromo-2-(2-ethoxy-2-keto-ethoxy)benzyl]thio]carbonimidoyl]ammonium chloride Formula: C12H16BrClN2O3S MolecularWeight: 383.68904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C=C(C=C1)Br)CSC(=N)[NH3+].[Cl-]

Isomeric SMILES

CCOC(=O)COC1=C(C=C(C=C1)Br)CSC(=N)[NH3+].[Cl-]

InChI

InChI=1S/C12H15BrN2O3S.ClH/c1-2-17-11(16)6-18-10-4-3-9(13)5-8(10)7-19-12(14)15;/h3-5H,2,6-7H2,1H3,(H3,14,15);1H