N-methyl-2,3,4-tris(oxidanyl)butanamide; 3-oxidanylidene-1,2-dihydroisoindole-1-sulfonamide

Systemtic Name: N-methyl-2,3,4-tris(oxidanyl)butanamide; 3-oxidanylidene-1,2-dihydroisoindole-1-sulfonamide Openeye Name: 3-oxoisoindoline-1-sulfonamide; 2,3,4-trihydroxy-N-methyl-butanamide CAS Name: 3-oxo-1,2-dihydroisoindole-1-sulfonamide; 2,3,4-trihydroxy-N-methylbutanamide IUPAC Name: 3-oxo-1,2-dihydroisoindole-1-sulfonamide; 2,3,4-trihydroxy-N-methylbutanamide Traditional Name: 3-ketoisoindoline-1-sulfonamide; 2,3,4-trihydroxy-N-methyl-butyramide Formula: C13H19N3O7S MolecularWeight: 361.37086

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C(C(CO)O)O.C1=CC=C2C(=C1)C(NC2=O)S(=O)(=O)N

Isomeric SMILES

CNC(=O)C(C(CO)O)O.C1=CC=C2C(=C1)C(NC2=O)S(=O)(=O)N

InChI

InChI=1S/C8H8N2O3S.C5H11NO4/c9-14(12,13)8-6-4-2-1-3-5(6)7(11)10-8;1-6-5(10)4(9)3(8)2-7/h1-4,8H,(H,10,11)(H2,9,12,13);3-4,7-9H,2H2,1H3,(H,6,10)