2-piperazin-1-yl-5-(trifluoromethyl)benzenesulfonic acid

Systemtic Name: 2-piperazin-1-yl-5-(trifluoromethyl)benzenesulfonic acid Openeye Name: 2-piperazin-1-yl-5-(trifluoromethyl)benzenesulfonic acid CAS Name: 2-(1-piperazinyl)-5-(trifluoromethyl)benzenesulfonic acid IUPAC Name: 2-piperazin-1-yl-5-(trifluoromethyl)benzenesulfonic acid Traditional Name: 2-piperazino-5-(trifluoromethyl)besylic acid Formula: C11H13F3N2O3S MolecularWeight: 310.29273

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C(C=C2)C(F)(F)F)S(=O)(=O)O

Isomeric SMILES

C1CN(CCN1)C2=C(C=C(C=C2)C(F)(F)F)S(=O)(=O)O

InChI

InChI=1S/C11H13F3N2O3S/c12-11(13,14)8-1-2-9(10(7-8)20(17,18)19)16-5-3-15-4-6-16/h1-2,7,15H,3-6H2,(H,17,18,19)