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

Systemtic Name: 4-methyl-3-(1,2,4-oxadiazol-3-ylmethylsulfonyl)benzoic acid Openeye Name: 4-methyl-3-(1,2,4-oxadiazol-3-ylmethylsulfonyl)benzoic acid CAS Name: 4-methyl-3-(1,2,4-oxadiazol-3-ylmethylsulfonyl)benzoic acid IUPAC Name: 4-methyl-3-(1,2,4-oxadiazol-3-ylmethylsulfonyl)benzoic acid Traditional Name: 4-methyl-3-(1,2,4-oxadiazol-3-ylmethylsulfonyl)benzoic acid Formula: C11H10N2O5S MolecularWeight: 282.2725

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)CC2=NOC=N2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)CC2=NOC=N2

InChI

InChI=1S/C11H10N2O5S/c1-7-2-3-8(11(14)15)4-9(7)19(16,17)5-10-12-6-18-13-10/h2-4,6H,5H2,1H3,(H,14,15)