N-methyl-N-(1-methylpiperidin-1-ium-4-yl)-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanamide

Systemtic Name: N-methyl-N-(1-methylpiperidin-1-ium-4-yl)-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanamide Openeye Name: N-methyl-N-(1-methylpiperidin-1-ium-4-yl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide CAS Name: N-methyl-N-(1-methyl-4-piperidin-1-iumyl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide IUPAC Name: N-methyl-N-(1-methylpiperidin-1-ium-4-yl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide Traditional Name: N-methyl-N-(1-methylpiperidin-1-ium-4-yl)-2-(1,1,3-triketo-1,2-benzothiazol-2-yl)acetamide Formula: C16H22N3O4S+ MolecularWeight: 352.42858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)C(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)C(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C16H21N3O4S/c1-17-9-7-12(8-10-17)18(2)15(20)11-19-16(21)13-5-3-4-6-14(13)24(19,22)23/h3-6,12H,7-11H2,1-2H3/p+1