2-[2-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylethylazanium

Systemtic Name: 2-[2-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylethylazanium Openeye Name: 2-[2-(4-chloro-2,5-dimethoxy-anilino)-2-oxo-ethyl]sulfanylethylammonium CAS Name: 2-[[2-(4-chloro-2,5-dimethoxyanilino)-2-oxoethyl]thio]ethylammonium IUPAC Name: 2-[2-(4-chloro-2,5-dimethoxyanilino)-2-oxoethyl]sulfanylethylazanium Traditional Name: 2-[[2-(4-chloro-2,5-dimethoxy-anilino)-2-keto-ethyl]thio]ethylammonium Formula: C12H18ClN2O3S+ MolecularWeight: 305.80092

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)CSCC[NH3+])OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)CSCC[NH3+])OC)Cl

InChI

InChI=1S/C12H17ClN2O3S/c1-17-10-6-9(11(18-2)5-8(10)13)15-12(16)7-19-4-3-14/h5-6H,3-4,7,14H2,1-2H3,(H,15,16)/p+1