2-[(4-methanoylphenyl)-(2-sulfoethyl)amino]ethanesulfonic acid

Systemtic Name: 2-[(4-methanoylphenyl)-(2-sulfoethyl)amino]ethanesulfonic acid Openeye Name: 2-[4-formyl-N-(2-sulfoethyl)anilino]ethanesulfonic acid CAS Name: 2-[4-formyl-N-(2-sulfoethyl)anilino]ethanesulfonic acid IUPAC Name: 2-[4-formyl-N-(2-sulfoethyl)anilino]ethanesulfonic acid Traditional Name: 2-[4-formyl-N-(2-sulfoethyl)anilino]ethanesulfonic acid Formula: C11H15NO7S2 MolecularWeight: 337.3693

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=O)N(CCS(=O)(=O)O)CCS(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1C=O)N(CCS(=O)(=O)O)CCS(=O)(=O)O

InChI

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