2-bromanyl-N-[2-(6-methoxy-3-oxidanylidene-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]ethanamide

Systemtic Name: 2-bromanyl-N-[2-(6-methoxy-3-oxidanylidene-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]ethanamide Openeye Name: 2-bromo-N-[2-(6-methoxy-3-oxo-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]acetamide CAS Name: 2-bromo-N-[2-(6-methoxy-3-oxo-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]acetamide IUPAC Name: 2-bromo-N-[2-(6-methoxy-3-oxo-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]acetamide Traditional Name: 2-bromo-N-[2-(3-keto-6-methoxy-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]acetamide Formula: C12H14BrN2O3S+ MolecularWeight: 346.22016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)[N+](=O)C(S2)CCNC(=O)CBr

Isomeric SMILES

COC1=CC2=C(C=C1)[N+](=O)C(S2)CCNC(=O)CBr

InChI

InChI=1S/C12H13BrN2O3S/c1-18-8-2-3-9-10(6-8)19-12(15(9)17)4-5-14-11(16)7-13/h2-3,6,12H,4-5,7H2,1H3/p+1