3-(3-oxidanylidenepiperazin-1-yl)sulfonylbenzoic acid

Systemtic Name: 3-(3-oxidanylidenepiperazin-1-yl)sulfonylbenzoic acid Openeye Name: 3-(3-oxopiperazin-1-yl)sulfonylbenzoic acid CAS Name: 3-[(3-oxo-1-piperazinyl)sulfonyl]benzoic acid IUPAC Name: 3-(3-oxopiperazin-1-yl)sulfonylbenzoic acid Traditional Name: 3-(3-ketopiperazino)sulfonylbenzoic acid Formula: C11H12N2O5S MolecularWeight: 284.28838

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)S(=O)(=O)C2=CC=CC(=C2)C(=O)O

Isomeric SMILES

C1CN(CC(=O)N1)S(=O)(=O)C2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C11H12N2O5S/c14-10-7-13(5-4-12-10)19(17,18)9-3-1-2-8(6-9)11(15)16/h1-3,6H,4-5,7H2,(H,12,14)(H,15,16)