2-(2-benzamidoethylsulfonyl)ethyl hydrogen sulfate

Systemtic Name: 2-(2-benzamidoethylsulfonyl)ethyl hydrogen sulfate Openeye Name: 2-(2-benzamidoethylsulfonyl)ethyl hydrogen sulfate CAS Name: sulfuric acid 2-(2-benzamidoethylsulfonyl)ethyl ester IUPAC Name: 2-(2-benzamidoethylsulfonyl)ethyl hydrogen sulfate Traditional Name: sulfuric acid 2-(2-benzamidoethylsulfonyl)ethyl ester Formula: C11H15NO7S2 MolecularWeight: 337.3693

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NCCS(=O)(=O)CCOS(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NCCS(=O)(=O)CCOS(=O)(=O)O

InChI

InChI=1S/C11H15NO7S2/c13-11(10-4-2-1-3-5-10)12-6-8-20(14,15)9-7-19-21(16,17)18/h1-5H,6-9H2,(H,12,13)(H,16,17,18)