5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-2-oxidanyl-benzoic acid hydrochloride

Systemtic Name: 5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-2-oxidanyl-benzoic acid hydrochloride Openeye Name: 2-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-benzoic acid hydrochloride CAS Name: 2-hydroxy-5-[[4-(2-hydroxyethyl)-1-piperazinyl]sulfonyl]benzoic acid hydrochloride IUPAC Name: 2-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonylbenzoic acid hydrochloride Traditional Name: 2-hydroxy-5-[4-(2-hydroxyethyl)piperazino]sulfonyl-benzoic acid hydrochloride Formula: C13H19ClN2O6S MolecularWeight: 366.81776

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)S(=O)(=O)C2=CC(=C(C=C2)O)C(=O)O.Cl

Isomeric SMILES

C1CN(CCN1CCO)S(=O)(=O)C2=CC(=C(C=C2)O)C(=O)O.Cl

InChI

InChI=1S/C13H18N2O6S.ClH/c16-8-7-14-3-5-15(6-4-14)22(20,21)10-1-2-12(17)11(9-10)13(18)19;/h1-2,9,16-17H,3-8H2,(H,18,19);1H