2-[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfinylethanoic acid

Systemtic Name: 2-[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfinylethanoic acid Openeye Name: 2-[2-(4-ethylanilino)-2-oxo-ethyl]sulfinylacetic acid CAS Name: 2-[2-(4-ethylanilino)-2-oxoethyl]sulfinylacetic acid IUPAC Name: 2-[2-(4-ethylanilino)-2-oxoethyl]sulfinylacetic acid Traditional Name: 2-[2-(4-ethylanilino)-2-keto-ethyl]sulfinylacetic acid Formula: C12H15NO4S MolecularWeight: 269.3168

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CS(=O)CC(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CS(=O)CC(=O)O

InChI

InChI=1S/C12H15NO4S/c1-2-9-3-5-10(6-4-9)13-11(14)7-18(17)8-12(15)16/h3-6H,2,7-8H2,1H3,(H,13,14)(H,15,16)