2-(carboxymethyloxy)-5-[3-(methylamino)-2-(methylsulfonylamino)-3-oxidanylidene-propyl]benzoic acid

Systemtic Name: 2-(carboxymethyloxy)-5-[3-(methylamino)-2-(methylsulfonylamino)-3-oxidanylidene-propyl]benzoic acid Openeye Name: 2-(carboxymethyloxy)-5-[2-(methanesulfonamido)-3-(methylamino)-3-oxo-propyl]benzoic acid CAS Name: 2-(carboxymethyloxy)-5-[2-(methanesulfonamido)-3-(methylamino)-3-oxopropyl]benzoic acid IUPAC Name: 2-(carboxymethyloxy)-5-[2-(methanesulfonamido)-3-(methylamino)-3-oxopropyl]benzoic acid Traditional Name: 2-(carboxymethyloxy)-5-[3-keto-2-(methanesulfonamido)-3-(methylamino)propyl]benzoic acid Formula: C14H18N2O8S MolecularWeight: 374.36632

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C(CC1=CC(=C(C=C1)OCC(=O)O)C(=O)O)NS(=O)(=O)C

Isomeric SMILES

CNC(=O)C(CC1=CC(=C(C=C1)OCC(=O)O)C(=O)O)NS(=O)(=O)C

InChI

InChI=1S/C14H18N2O8S/c1-15-13(19)10(16-25(2,22)23)6-8-3-4-11(24-7-12(17)18)9(5-8)14(20)21/h3-5,10,16H,6-7H2,1-2H3,(H,15,19)(H,17,18)(H,20,21)