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

Systemtic Name: 4-[[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfonylmethyl]benzoic acid Openeye Name: 4-[[2-(4-ethylanilino)-2-oxo-ethyl]sulfonylmethyl]benzoic acid CAS Name: 4-[[2-(4-ethylanilino)-2-oxoethyl]sulfonylmethyl]benzoic acid IUPAC Name: 4-[[2-(4-ethylanilino)-2-oxoethyl]sulfonylmethyl]benzoic acid Traditional Name: 4-[[2-(4-ethylanilino)-2-keto-ethyl]sulfonylmethyl]benzoic acid Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CS(=O)(=O)CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CS(=O)(=O)CC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C18H19NO5S/c1-2-13-5-9-16(10-6-13)19-17(20)12-25(23,24)11-14-3-7-15(8-4-14)18(21)22/h3-10H,2,11-12H2,1H3,(H,19,20)(H,21,22)