3-(1,2,4-oxadiazol-3-ylmethylsulfonyl)benzoic acid

Systemtic Name: 3-(1,2,4-oxadiazol-3-ylmethylsulfonyl)benzoic acid Openeye Name: 3-(1,2,4-oxadiazol-3-ylmethylsulfonyl)benzoic acid CAS Name: 3-(1,2,4-oxadiazol-3-ylmethylsulfonyl)benzoic acid IUPAC Name: 3-(1,2,4-oxadiazol-3-ylmethylsulfonyl)benzoic acid Traditional Name: 3-(1,2,4-oxadiazol-3-ylmethylsulfonyl)benzoic acid Formula: C10H8N2O5S MolecularWeight: 268.24592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)CC2=NOC=N2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)CC2=NOC=N2)C(=O)O

InChI

InChI=1S/C10H8N2O5S/c13-10(14)7-2-1-3-8(4-7)18(15,16)5-9-11-6-17-12-9/h1-4,6H,5H2,(H,13,14)