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

Systemtic Name: 2-[6-[[3-(dimethylsulfamoyl)-4-methoxy-phenyl]sulfamoyl]-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoic acid Openeye Name: 2-[6-[[3-(dimethylsulfamoyl)-4-methoxy-phenyl]sulfamoyl]-3-oxo-1,4-benzoxazin-4-yl]acetic acid CAS Name: 2-[6-[[3-(dimethylsulfamoyl)-4-methoxyphenyl]sulfamoyl]-3-oxo-1,4-benzoxazin-4-yl]acetic acid IUPAC Name: 2-[6-[[3-(dimethylsulfamoyl)-4-methoxyphenyl]sulfamoyl]-3-oxo-1,4-benzoxazin-4-yl]acetic acid Traditional Name: 2-[6-[[3-(dimethylsulfamoyl)-4-methoxy-phenyl]sulfamoyl]-3-keto-1,4-benzoxazin-4-yl]acetic acid Formula: C19H21N3O9S2 MolecularWeight: 499.51474

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=C(C=CC(=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3CC(=O)O)OC

Isomeric SMILES

CN(C)S(=O)(=O)C1=C(C=CC(=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3CC(=O)O)OC

InChI

InChI=1S/C19H21N3O9S2/c1-21(2)33(28,29)17-8-12(4-6-16(17)30-3)20-32(26,27)13-5-7-15-14(9-13)22(10-19(24)25)18(23)11-31-15/h4-9,20H,10-11H2,1-3H3,(H,24,25)