2-[(3,4-dimethoxyphenyl)-methylsulfonyl-amino]ethanoic acid

Systemtic Name: 2-[(3,4-dimethoxyphenyl)-methylsulfonyl-amino]ethanoic acid Openeye Name: 2-(3,4-dimethoxy-N-methylsulfonyl-anilino)acetic acid CAS Name: 2-(3,4-dimethoxy-N-methylsulfonylanilino)acetic acid IUPAC Name: 2-(3,4-dimethoxy-N-methylsulfonylanilino)acetic acid Traditional Name: 2-(N-mesyl-3,4-dimethoxy-anilino)acetic acid Formula: C11H15NO6S MolecularWeight: 289.3049

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CC(=O)O)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N(CC(=O)O)S(=O)(=O)C)OC

InChI

InChI=1S/C11H15NO6S/c1-17-9-5-4-8(6-10(9)18-2)12(7-11(13)14)19(3,15)16/h4-6H,7H2,1-3H3,(H,13,14)