ethyl 6-chloranyl-2-ethyl-1,1,3-tris(oxidanylidene)-4H-1$l^{6},2-benzothiazine-4-carboxylate

Systemtic Name: ethyl 6-chloranyl-2-ethyl-1,1,3-tris(oxidanylidene)-4H-1$l^{6},2-benzothiazine-4-carboxylate Openeye Name: ethyl 6-chloro-2-ethyl-1,1,3-trioxo-4H-1$l^{6},2-benzothiazine-4-carboxylate CAS Name: 6-chloro-2-ethyl-1,1,3-trioxo-4H-1$l^{6},2-benzothiazine-4-carboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-2-ethyl-1,1,3-trioxo-4H-1$l^{6},2-benzothiazine-4-carboxylate Traditional Name: 6-chloro-2-ethyl-1,1,3-triketo-4H-1$l^{6},2-benzothiazine-4-carboxylic acid ethyl ester Formula: C13H14ClNO5S MolecularWeight: 331.77196

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(C2=C(S1(=O)=O)C=CC(=C2)Cl)C(=O)OCC

Isomeric SMILES

CCN1C(=O)C(C2=C(S1(=O)=O)C=CC(=C2)Cl)C(=O)OCC

InChI

InChI=1S/C13H14ClNO5S/c1-3-15-12(16)11(13(17)20-4-2)9-7-8(14)5-6-10(9)21(15,18)19/h5-7,11H,3-4H2,1-2H3