ethyl 2-(5-methyl-7-nitro-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: ethyl 2-(5-methyl-7-nitro-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoate Openeye Name: ethyl 2-(5-methyl-7-nitro-2-oxo-1,3-benzothiazol-3-yl)acetate CAS Name: 2-(5-methyl-7-nitro-2-oxo-1,3-benzothiazol-3-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(5-methyl-7-nitro-2-oxo-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(2-keto-5-methyl-7-nitro-1,3-benzothiazol-3-yl)acetic acid ethyl ester Formula: C12H12N2O5S MolecularWeight: 296.29908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C(=CC(=C2)C)[N+](=O)[O-])SC1=O

Isomeric SMILES

CCOC(=O)CN1C2=C(C(=CC(=C2)C)[N+](=O)[O-])SC1=O

InChI

InChI=1S/C12H12N2O5S/c1-3-19-10(15)6-13-8-4-7(2)5-9(14(17)18)11(8)20-12(13)16/h4-5H,3,6H2,1-2H3