N-[2-(5-methoxy-3-oxidanylidene-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]ethanamide

Systemtic Name: N-[2-(5-methoxy-3-oxidanylidene-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]ethanamide Openeye Name: N-[2-(5-methoxy-3-oxo-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]acetamide CAS Name: N-[2-(5-methoxy-3-oxo-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]acetamide IUPAC Name: N-[2-(5-methoxy-3-oxo-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]acetamide Traditional Name: N-[2-(3-keto-5-methoxy-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]acetamide Formula: C12H15N2O3S+ MolecularWeight: 267.3241

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC1[N+](=O)C2=C(S1)C=CC(=C2)OC

Isomeric SMILES

CC(=O)NCCC1[N+](=O)C2=C(S1)C=CC(=C2)OC

InChI

InChI=1S/C12H14N2O3S/c1-8(15)13-6-5-12-14(16)10-7-9(17-2)3-4-11(10)18-12/h3-4,7,12H,5-6H2,1-2H3/p+1