3-(aziridin-1-ylsulfonyl)-5-iodanyl-benzoic acid

Systemtic Name: 3-(aziridin-1-ylsulfonyl)-5-iodanyl-benzoic acid Openeye Name: 3-(aziridin-1-ylsulfonyl)-5-iodo-benzoic acid CAS Name: 3-(1-aziridinylsulfonyl)-5-iodobenzoic acid IUPAC Name: 3-(aziridin-1-ylsulfonyl)-5-iodobenzoic acid Traditional Name: 3-ethyleniminosulfonyl-5-iodo-benzoic acid Formula: C9H8INO4S MolecularWeight: 353.13359

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Descriptors Computed from Structure

Canonical SMILES:

C1CN1S(=O)(=O)C2=CC(=CC(=C2)C(=O)O)I

Isomeric SMILES

C1CN1S(=O)(=O)C2=CC(=CC(=C2)C(=O)O)I

InChI

InChI=1S/C9H8INO4S/c10-7-3-6(9(12)13)4-8(5-7)16(14,15)11-1-2-11/h3-5H,1-2H2,(H,12,13)