ethyl 3,5-dimethyl-7-nitro-4H-1,4-benzothiazine-2-carboxylate

Systemtic Name: ethyl 3,5-dimethyl-7-nitro-4H-1,4-benzothiazine-2-carboxylate Openeye Name: ethyl 3,5-dimethyl-7-nitro-4H-1,4-benzothiazine-2-carboxylate CAS Name: 3,5-dimethyl-7-nitro-4H-1,4-benzothiazine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dimethyl-7-nitro-4H-1,4-benzothiazine-2-carboxylate Traditional Name: 3,5-dimethyl-7-nitro-4H-1,4-benzothiazine-2-carboxylic acid ethyl ester Formula: C13H14N2O4S MolecularWeight: 294.32626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(S1)C=C(C=C2C)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(S1)C=C(C=C2C)[N+](=O)[O-])C

InChI

InChI=1S/C13H14N2O4S/c1-4-19-13(16)12-8(3)14-11-7(2)5-9(15(17)18)6-10(11)20-12/h5-6,14H,4H2,1-3H3