1-cyanoethyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate

Systemtic Name: 1-cyanoethyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate Openeye Name: 1-cyanoethyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate CAS Name: 3-oxo-4H-1,4-benzothiazine-6-carboxylic acid 1-cyanoethyl ester IUPAC Name: 1-cyanoethyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate Traditional Name: 3-keto-4H-1,4-benzothiazine-6-carboxylic acid 1-cyanoethyl ester Formula: C12H10N2O3S MolecularWeight: 262.2844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)C1=CC2=C(C=C1)SCC(=O)N2

Isomeric SMILES

CC(C#N)OC(=O)C1=CC2=C(C=C1)SCC(=O)N2

InChI

InChI=1S/C12H10N2O3S/c1-7(5-13)17-12(16)8-2-3-10-9(4-8)14-11(15)6-18-10/h2-4,7H,6H2,1H3,(H,14,15)