2-[[4-azanyl-2,5-bis(chloranyl)phenyl]sulfonyl-methyl-amino]ethyl hydrogen sulfate

Systemtic Name: 2-[[4-azanyl-2,5-bis(chloranyl)phenyl]sulfonyl-methyl-amino]ethyl hydrogen sulfate Openeye Name: 2-[(4-amino-2,5-dichloro-phenyl)sulfonyl-methyl-amino]ethyl hydrogen sulfate CAS Name: sulfuric acid 2-[(4-amino-2,5-dichlorophenyl)sulfonyl-methylamino]ethyl ester IUPAC Name: 2-[(4-amino-2,5-dichlorophenyl)sulfonyl-methylamino]ethyl hydrogen sulfate Traditional Name: sulfuric acid 2-[(4-amino-2,5-dichloro-phenyl)sulfonyl-methyl-amino]ethyl ester Formula: C9H12Cl2N2O6S2 MolecularWeight: 379.23738

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOS(=O)(=O)O)S(=O)(=O)C1=C(C=C(C(=C1)Cl)N)Cl

Isomeric SMILES

CN(CCOS(=O)(=O)O)S(=O)(=O)C1=C(C=C(C(=C1)Cl)N)Cl

InChI

InChI=1S/C9H12Cl2N2O6S2/c1-13(2-3-19-21(16,17)18)20(14,15)9-5-6(10)8(12)4-7(9)11/h4-5H,2-3,12H2,1H3,(H,16,17,18)