5-[[[3,4-dimethyl-5-(methylsulfamoyl)phenyl]carbonylamino]methyl]-2-methoxy-benzoic acid

Systemtic Name: 5-[[[3,4-dimethyl-5-(methylsulfamoyl)phenyl]carbonylamino]methyl]-2-methoxy-benzoic acid Openeye Name: 5-[[[3,4-dimethyl-5-(methylsulfamoyl)benzoyl]amino]methyl]-2-methoxy-benzoic acid CAS Name: 5-[[[[3,4-dimethyl-5-(methylsulfamoyl)phenyl]-oxomethyl]amino]methyl]-2-methoxybenzoic acid IUPAC Name: 5-[[[3,4-dimethyl-5-(methylsulfamoyl)benzoyl]amino]methyl]-2-methoxybenzoic acid Traditional Name: 5-[[[3,4-dimethyl-5-(methylsulfamoyl)benzoyl]amino]methyl]-2-methoxy-benzoic acid Formula: C19H22N2O6S MolecularWeight: 406.45278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)NCC2=CC(=C(C=C2)OC)C(=O)O)S(=O)(=O)NC)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)NCC2=CC(=C(C=C2)OC)C(=O)O)S(=O)(=O)NC)C

InChI

InChI=1S/C19H22N2O6S/c1-11-7-14(9-17(12(11)2)28(25,26)20-3)18(22)21-10-13-5-6-16(27-4)15(8-13)19(23)24/h5-9,20H,10H2,1-4H3,(H,21,22)(H,23,24)