1-cyanoethyl 2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoate

Systemtic Name: 1-cyanoethyl 2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoate Openeye Name: 1-cyanoethyl 2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetate CAS Name: 2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetic acid 1-cyanoethyl ester IUPAC Name: 1-cyanoethyl 2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetate Traditional Name: 2-(3-keto-4H-1,4-benzothiazin-2-yl)acetic acid 1-cyanoethyl ester Formula: C13H12N2O3S MolecularWeight: 276.31098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)CC1C(=O)NC2=CC=CC=C2S1

Isomeric SMILES

CC(C#N)OC(=O)CC1C(=O)NC2=CC=CC=C2S1

InChI

InChI=1S/C13H12N2O3S/c1-8(7-14)18-12(16)6-11-13(17)15-9-4-2-3-5-10(9)19-11/h2-5,8,11H,6H2,1H3,(H,15,17)