5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-2-oxidanyl-benzoate

Systemtic Name: 5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-2-oxidanyl-benzoate Openeye Name: 2-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-benzoate CAS Name: 2-hydroxy-5-[[4-(2-hydroxyethyl)-1-piperazinyl]sulfonyl]benzoate IUPAC Name: 2-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonylbenzoate Traditional Name: 2-hydroxy-5-[4-(2-hydroxyethyl)piperazino]sulfonyl-benzoate Formula: C13H17N2O6S- MolecularWeight: 329.34888

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)S(=O)(=O)C2=CC(=C(C=C2)O)C(=O)[O-]

Isomeric SMILES

C1CN(CCN1CCO)S(=O)(=O)C2=CC(=C(C=C2)O)C(=O)[O-]

InChI

InChI=1S/C13H18N2O6S/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)/p-1