3-[[1,1-bis(oxidanylidene)thian-4-yl]amino]benzoic acid

Systemtic Name: 3-[[1,1-bis(oxidanylidene)thian-4-yl]amino]benzoic acid Openeye Name: 3-[(1,1-dioxothian-4-yl)amino]benzoic acid CAS Name: 3-[(1,1-dioxo-4-thianyl)amino]benzoic acid IUPAC Name: 3-[(1,1-dioxothian-4-yl)amino]benzoic acid Traditional Name: 3-[(1,1-diketothian-4-yl)amino]benzoic acid Formula: C12H15NO4S MolecularWeight: 269.3168

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCC1NC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

C1CS(=O)(=O)CCC1NC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C12H15NO4S/c14-12(15)9-2-1-3-11(8-9)13-10-4-6-18(16,17)7-5-10/h1-3,8,10,13H,4-7H2,(H,14,15)