5-[2-(tert-butylamino)-2-oxidanylidene-ethyl]sulfonyl-2-methyl-benzoic acid

Systemtic Name: 5-[2-(tert-butylamino)-2-oxidanylidene-ethyl]sulfonyl-2-methyl-benzoic acid Openeye Name: 5-[2-(tert-butylamino)-2-oxo-ethyl]sulfonyl-2-methyl-benzoic acid CAS Name: 5-[2-(tert-butylamino)-2-oxoethyl]sulfonyl-2-methylbenzoic acid IUPAC Name: 5-[2-(tert-butylamino)-2-oxoethyl]sulfonyl-2-methylbenzoic acid Traditional Name: 5-[2-(tert-butylamino)-2-keto-ethyl]sulfonyl-2-methyl-benzoic acid Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)CC(=O)NC(C)(C)C)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)CC(=O)NC(C)(C)C)C(=O)O

InChI

InChI=1S/C14H19NO5S/c1-9-5-6-10(7-11(9)13(17)18)21(19,20)8-12(16)15-14(2,3)4/h5-7H,8H2,1-4H3,(H,15,16)(H,17,18)