2-azanyl-5-[3-(2-hydroxyethylsulfonyl)propylamino]benzenesulfonic acid

Systemtic Name: 2-azanyl-5-[3-(2-hydroxyethylsulfonyl)propylamino]benzenesulfonic acid Openeye Name: 2-amino-5-[3-(2-hydroxyethylsulfonyl)propylamino]benzenesulfonic acid CAS Name: 2-amino-5-[3-(2-hydroxyethylsulfonyl)propylamino]benzenesulfonic acid IUPAC Name: 2-amino-5-[3-(2-hydroxyethylsulfonyl)propylamino]benzenesulfonic acid Traditional Name: 2-amino-5-[3-(2-hydroxyethylsulfonyl)propylamino]besylic acid Formula: C11H18N2O6S2 MolecularWeight: 338.40042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NCCCS(=O)(=O)CCO)S(=O)(=O)O)N

Isomeric SMILES

C1=CC(=C(C=C1NCCCS(=O)(=O)CCO)S(=O)(=O)O)N

InChI

InChI=1S/C11H18N2O6S2/c12-10-3-2-9(8-11(10)21(17,18)19)13-4-1-6-20(15,16)7-5-14/h2-3,8,13-14H,1,4-7,12H2,(H,17,18,19)