2-[(3-chlorophenyl)-(2-sulfoethyl)amino]ethanesulfonic acid

Systemtic Name: 2-[(3-chlorophenyl)-(2-sulfoethyl)amino]ethanesulfonic acid Openeye Name: 2-[3-chloro-N-(2-sulfoethyl)anilino]ethanesulfonic acid CAS Name: 2-[3-chloro-N-(2-sulfoethyl)anilino]ethanesulfonic acid IUPAC Name: 2-[3-chloro-N-(2-sulfoethyl)anilino]ethanesulfonic acid Traditional Name: 2-[3-chloro-N-(2-sulfoethyl)anilino]ethanesulfonic acid Formula: C10H14ClNO6S2 MolecularWeight: 343.80426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)N(CCS(=O)(=O)O)CCS(=O)(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)N(CCS(=O)(=O)O)CCS(=O)(=O)O

InChI

InChI=1S/C10H14ClNO6S2/c11-9-2-1-3-10(8-9)12(4-6-19(13,14)15)5-7-20(16,17)18/h1-3,8H,4-7H2,(H,13,14,15)(H,16,17,18)