2-methyl-N-[2-(3-oxidanylidene-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]propanamide

Systemtic Name: 2-methyl-N-[2-(3-oxidanylidene-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]propanamide Openeye Name: 2-methyl-N-[2-(3-oxo-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]propanamide CAS Name: 2-methyl-N-[2-(3-oxo-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]propanamide IUPAC Name: 2-methyl-N-[2-(3-oxo-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]propanamide Traditional Name: N-[2-(3-keto-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]-2-methyl-propionamide Formula: C13H17N2O2S+ MolecularWeight: 265.35128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCC1[N+](=O)C2=CC=CC=C2S1

Isomeric SMILES

CC(C)C(=O)NCCC1[N+](=O)C2=CC=CC=C2S1

InChI

InChI=1S/C13H16N2O2S/c1-9(2)13(16)14-8-7-12-15(17)10-5-3-4-6-11(10)18-12/h3-6,9,12H,7-8H2,1-2H3/p+1