5-[2-cyanoethyl(methyl)sulfamoyl]-2-methoxy-benzoic acid

Systemtic Name: 5-[2-cyanoethyl(methyl)sulfamoyl]-2-methoxy-benzoic acid Openeye Name: 5-[2-cyanoethyl(methyl)sulfamoyl]-2-methoxy-benzoic acid CAS Name: 5-[2-cyanoethyl(methyl)sulfamoyl]-2-methoxybenzoic acid IUPAC Name: 5-[2-cyanoethyl(methyl)sulfamoyl]-2-methoxybenzoic acid Traditional Name: 5-[2-cyanoethyl(methyl)sulfamoyl]-2-methoxy-benzoic acid Formula: C12H14N2O5S MolecularWeight: 298.31496

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)S(=O)(=O)C1=CC(=C(C=C1)OC)C(=O)O

Isomeric SMILES

CN(CCC#N)S(=O)(=O)C1=CC(=C(C=C1)OC)C(=O)O

InChI

InChI=1S/C12H14N2O5S/c1-14(7-3-6-13)20(17,18)9-4-5-11(19-2)10(8-9)12(15)16/h4-5,8H,3,7H2,1-2H3,(H,15,16)