4-(4-fluorophenyl)sulfonylpiperazine-1,3-dicarboxylic acid

Systemtic Name: 4-(4-fluorophenyl)sulfonylpiperazine-1,3-dicarboxylic acid Openeye Name: 4-(4-fluorophenyl)sulfonylpiperazine-1,3-dicarboxylic acid CAS Name: 4-(4-fluorophenyl)sulfonylpiperazine-1,3-dicarboxylic acid IUPAC Name: 4-(4-fluorophenyl)sulfonylpiperazine-1,3-dicarboxylic acid Traditional Name: 4-(4-fluorophenyl)sulfonylpiperazine-1,3-dicarboxylic acid Formula: C12H13FN2O6S MolecularWeight: 332.304823

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1C(=O)O)C(=O)O)S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

C1CN(C(CN1C(=O)O)C(=O)O)S(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C12H13FN2O6S/c13-8-1-3-9(4-2-8)22(20,21)15-6-5-14(12(18)19)7-10(15)11(16)17/h1-4,10H,5-7H2,(H,16,17)(H,18,19)