3-[2-(2-oxidanylideneimidazolidin-1-yl)ethylsulfonyl]benzoic acid

Systemtic Name: 3-[2-(2-oxidanylideneimidazolidin-1-yl)ethylsulfonyl]benzoic acid Openeye Name: 3-[2-(2-oxoimidazolidin-1-yl)ethylsulfonyl]benzoic acid CAS Name: 3-[2-(2-oxo-1-imidazolidinyl)ethylsulfonyl]benzoic acid IUPAC Name: 3-[2-(2-oxoimidazolidin-1-yl)ethylsulfonyl]benzoic acid Traditional Name: 3-[2-(2-ketoimidazolidin-1-yl)ethylsulfonyl]benzoic acid Formula: C12H14N2O5S MolecularWeight: 298.31496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O5S/c15-11(16)9-2-1-3-10(8-9)20(18,19)7-6-14-5-4-13-12(14)17/h1-3,8H,4-7H2,(H,13,17)(H,15,16)