2-(5-azanyl-2,4-dimethyl-phenyl)sulfonylethyl hydrogen sulfate

Systemtic Name: 2-(5-azanyl-2,4-dimethyl-phenyl)sulfonylethyl hydrogen sulfate Openeye Name: 2-(5-amino-2,4-dimethyl-phenyl)sulfonylethyl hydrogen sulfate CAS Name: sulfuric acid 2-(5-amino-2,4-dimethylphenyl)sulfonylethyl ester IUPAC Name: 2-(5-amino-2,4-dimethylphenyl)sulfonylethyl hydrogen sulfate Traditional Name: sulfuric acid 2-(5-amino-2,4-dimethyl-phenyl)sulfonylethyl ester Formula: C10H15NO6S2 MolecularWeight: 309.3592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1N)S(=O)(=O)CCOS(=O)(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1N)S(=O)(=O)CCOS(=O)(=O)O)C

InChI

InChI=1S/C10H15NO6S2/c1-7-5-8(2)10(6-9(7)11)18(12,13)4-3-17-19(14,15)16/h5-6H,3-4,11H2,1-2H3,(H,14,15,16)