3-[2-(2-chloroethylsulfonyl)ethylamino]benzenesulfonic acid

Systemtic Name: 3-[2-(2-chloroethylsulfonyl)ethylamino]benzenesulfonic acid Openeye Name: 3-[2-(2-chloroethylsulfonyl)ethylamino]benzenesulfonic acid CAS Name: 3-[2-(2-chloroethylsulfonyl)ethylamino]benzenesulfonic acid IUPAC Name: 3-[2-(2-chloroethylsulfonyl)ethylamino]benzenesulfonic acid Traditional Name: 3-[2-(2-chloroethylsulfonyl)ethylamino]besylic acid Formula: C10H14ClNO5S2 MolecularWeight: 327.80486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)O)NCCS(=O)(=O)CCCl

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)O)NCCS(=O)(=O)CCCl

InChI

InChI=1S/C10H14ClNO5S2/c11-4-6-18(13,14)7-5-12-9-2-1-3-10(8-9)19(15,16)17/h1-3,8,12H,4-7H2,(H,15,16,17)