2-[(4-ethylphenyl)-methylsulfonyl-amino]ethanoate

Systemtic Name: 2-[(4-ethylphenyl)-methylsulfonyl-amino]ethanoate Openeye Name: 2-(4-ethyl-N-methylsulfonyl-anilino)acetate CAS Name: 2-(4-ethyl-N-methylsulfonylanilino)acetate IUPAC Name: 2-(4-ethyl-N-methylsulfonylanilino)acetate Traditional Name: 2-(4-ethyl-N-mesyl-anilino)acetate Formula: C11H14NO4S- MolecularWeight: 256.29816

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(CC(=O)[O-])S(=O)(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)N(CC(=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C11H15NO4S/c1-3-9-4-6-10(7-5-9)12(8-11(13)14)17(2,15)16/h4-7H,3,8H2,1-2H3,(H,13,14)/p-1