4-fluoranyl-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzoate

Systemtic Name: 4-fluoranyl-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzoate Openeye Name: 4-fluoro-3-(3-oxopiperazin-1-yl)sulfonyl-benzoate CAS Name: 4-fluoro-3-[(3-oxo-1-piperazinyl)sulfonyl]benzoate IUPAC Name: 4-fluoro-3-(3-oxopiperazin-1-yl)sulfonylbenzoate Traditional Name: 4-fluoro-3-(3-ketopiperazino)sulfonyl-benzoate Formula: C11H10FN2O5S- MolecularWeight: 301.270903

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)[O-])F

Isomeric SMILES

C1CN(CC(=O)N1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)[O-])F

InChI

InChI=1S/C11H11FN2O5S/c12-8-2-1-7(11(16)17)5-9(8)20(18,19)14-4-3-13-10(15)6-14/h1-2,5H,3-4,6H2,(H,13,15)(H,16,17)/p-1