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

Systemtic Name: 3-[(5-ethyl-1,3,4-oxadiazol-2-yl)methylsulfonyl]-4-methyl-benzoic acid Openeye Name: 3-[(5-ethyl-1,3,4-oxadiazol-2-yl)methylsulfonyl]-4-methyl-benzoic acid CAS Name: 3-[(5-ethyl-1,3,4-oxadiazol-2-yl)methylsulfonyl]-4-methylbenzoic acid IUPAC Name: 3-[(5-ethyl-1,3,4-oxadiazol-2-yl)methylsulfonyl]-4-methylbenzoic acid Traditional Name: 3-[(5-ethyl-1,3,4-oxadiazol-2-yl)methylsulfonyl]-4-methyl-benzoic acid Formula: C13H14N2O5S MolecularWeight: 310.32566

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(O1)CS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)C

Isomeric SMILES

CCC1=NN=C(O1)CS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)C

InChI

InChI=1S/C13H14N2O5S/c1-3-11-14-15-12(20-11)7-21(18,19)10-6-9(13(16)17)5-4-8(10)2/h4-6H,3,7H2,1-2H3,(H,16,17)