2-oxidanyl-5-[4-(phenylsulfonyl)piperazin-1-yl]benzoic acid

Systemtic Name: 2-oxidanyl-5-[4-(phenylsulfonyl)piperazin-1-yl]benzoic acid Openeye Name: 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-hydroxy-benzoic acid CAS Name: 5-[4-(benzenesulfonyl)-1-piperazinyl]-2-hydroxybenzoic acid IUPAC Name: 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-hydroxybenzoic acid Traditional Name: 5-(4-besylpiperazino)-2-hydroxy-benzoic acid Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)O)C(=O)O)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)O)C(=O)O)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H18N2O5S/c20-16-7-6-13(12-15(16)17(21)22)18-8-10-19(11-9-18)25(23,24)14-4-2-1-3-5-14/h1-7,12,20H,8-11H2,(H,21,22)