N-[3-(butylsulfamoyl)phenyl]-3-oxidanylidene-4H-1,4-benzoxazine-6-sulfonamide

Systemtic Name: N-[3-(butylsulfamoyl)phenyl]-3-oxidanylidene-4H-1,4-benzoxazine-6-sulfonamide Openeye Name: N-[3-(butylsulfamoyl)phenyl]-3-oxo-4H-1,4-benzoxazine-6-sulfonamide CAS Name: N-[3-(butylsulfamoyl)phenyl]-3-oxo-4H-1,4-benzoxazine-6-sulfonamide IUPAC Name: N-[3-(butylsulfamoyl)phenyl]-3-oxo-4H-1,4-benzoxazine-6-sulfonamide Traditional Name: N-[3-(butylsulfamoyl)phenyl]-3-keto-4H-1,4-benzoxazine-6-sulfonamide Formula: C18H21N3O6S2 MolecularWeight: 439.50584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC=CC(=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC=CC(=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3

InChI

InChI=1S/C18H21N3O6S2/c1-2-3-9-19-28(23,24)14-6-4-5-13(10-14)21-29(25,26)15-7-8-17-16(11-15)20-18(22)12-27-17/h4-8,10-11,19,21H,2-3,9,12H2,1H3,(H,20,22)