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

Systemtic Name: N-methyl-N-(1-methylpiperidin-1-ium-4-yl)-3-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]propanamide Openeye Name: N-methyl-N-(1-methylpiperidin-1-ium-4-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide CAS Name: N-methyl-N-(1-methyl-4-piperidin-1-iumyl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide IUPAC Name: N-methyl-N-(1-methylpiperidin-1-ium-4-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide Traditional Name: N-methyl-N-(1-methylpiperidin-1-ium-4-yl)-3-(1,1,3-triketo-1,2-benzothiazol-2-yl)propionamide Formula: C17H24N3O4S+ MolecularWeight: 366.45516

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)C(=O)CCN2C(=O)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)C(=O)CCN2C(=O)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C17H23N3O4S/c1-18-10-7-13(8-11-18)19(2)16(21)9-12-20-17(22)14-5-3-4-6-15(14)25(20,23)24/h3-6,13H,7-12H2,1-2H3/p+1