methyl 2-[6-bromanyl-1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanoate

Systemtic Name: methyl 2-[6-bromanyl-1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanoate Openeye Name: methyl 2-(6-bromo-1,1,3-trioxo-1,2-benzothiazol-2-yl)acetate CAS Name: 2-(6-bromo-1,1,3-trioxo-1,2-benzothiazol-2-yl)acetic acid methyl ester IUPAC Name: methyl 2-(6-bromo-1,1,3-trioxo-1,2-benzothiazol-2-yl)acetate Traditional Name: 2-(6-bromo-1,1,3-triketo-1,2-benzothiazol-2-yl)acetic acid methyl ester Formula: C10H8BrNO5S MolecularWeight: 334.14322

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)C2=C(S1(=O)=O)C=C(C=C2)Br

Isomeric SMILES

COC(=O)CN1C(=O)C2=C(S1(=O)=O)C=C(C=C2)Br

InChI

InChI=1S/C10H8BrNO5S/c1-17-9(13)5-12-10(14)7-3-2-6(11)4-8(7)18(12,15)16/h2-4H,5H2,1H3