2-[6-[[3-(methylsulfonylamino)phenyl]sulfamoyl]-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoic acid

Systemtic Name: 2-[6-[[3-(methylsulfonylamino)phenyl]sulfamoyl]-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoic acid Openeye Name: 2-[6-[[3-(methanesulfonamido)phenyl]sulfamoyl]-3-oxo-1,4-benzoxazin-4-yl]acetic acid CAS Name: 2-[6-[[3-(methanesulfonamido)phenyl]sulfamoyl]-3-oxo-1,4-benzoxazin-4-yl]acetic acid IUPAC Name: 2-[6-[[3-(methanesulfonamido)phenyl]sulfamoyl]-3-oxo-1,4-benzoxazin-4-yl]acetic acid Traditional Name: 2-[3-keto-6-[[3-(methanesulfonamido)phenyl]sulfamoyl]-1,4-benzoxazin-4-yl]acetic acid Formula: C17H17N3O8S2 MolecularWeight: 455.46218

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=CC(=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3CC(=O)O

Isomeric SMILES

CS(=O)(=O)NC1=CC=CC(=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3CC(=O)O

InChI

InChI=1S/C17H17N3O8S2/c1-29(24,25)18-11-3-2-4-12(7-11)19-30(26,27)13-5-6-15-14(8-13)20(9-17(22)23)16(21)10-28-15/h2-8,18-19H,9-10H2,1H3,(H,22,23)