2-tert-butyl-4-(hydroxymethyl)-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 2-tert-butyl-4-(hydroxymethyl)-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 2-tert-butyl-4-(hydroxymethyl)-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-tert-butyl-4-(hydroxymethyl)-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-tert-butyl-4-(hydroxymethyl)-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 2-tert-butyl-1,1-diketo-4-methylol-1,2-benzothiazol-3-one Formula: C12H15NO4S MolecularWeight: 269.3168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C2=C(C=CC=C2S1(=O)=O)CO

Isomeric SMILES

CC(C)(C)N1C(=O)C2=C(C=CC=C2S1(=O)=O)CO

InChI

InChI=1S/C12H15NO4S/c1-12(2,3)13-11(15)10-8(7-14)5-4-6-9(10)18(13,16)17/h4-6,14H,7H2,1-3H3