2-methoxy-5-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfonyl]benzoic acid

Systemtic Name: 2-methoxy-5-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfonyl]benzoic acid Openeye Name: 2-methoxy-5-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfonyl]benzoic acid CAS Name: 2-methoxy-5-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfonyl]benzoic acid IUPAC Name: 2-methoxy-5-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfonyl]benzoic acid Traditional Name: 2-methoxy-5-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfonyl]benzoic acid Formula: C12H12N2O6S MolecularWeight: 312.29848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)CS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)O

Isomeric SMILES

CC1=NOC(=N1)CS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C12H12N2O6S/c1-7-13-11(20-14-7)6-21(17,18)8-3-4-10(19-2)9(5-8)12(15)16/h3-5H,6H2,1-2H3,(H,15,16)