methyl 2-[(6-nitro-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethanoate

Systemtic Name: methyl 2-[(6-nitro-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethanoate Openeye Name: methyl 2-[(6-nitro-1,3-benzothiazol-2-yl)amino]-2-oxo-acetate CAS Name: 2-[(6-nitro-1,3-benzothiazol-2-yl)amino]-2-oxoacetic acid methyl ester IUPAC Name: methyl 2-[(6-nitro-1,3-benzothiazol-2-yl)amino]-2-oxoacetate Traditional Name: 2-keto-2-[(6-nitro-1,3-benzothiazol-2-yl)amino]acetic acid methyl ester Formula: C10H7N3O5S MolecularWeight: 281.24468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=O)NC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C(=O)NC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C10H7N3O5S/c1-18-9(15)8(14)12-10-11-6-3-2-5(13(16)17)4-7(6)19-10/h2-4H,1H3,(H,11,12,14)