ethyl 2-[4-(cyanomethyl)-3-oxidanylidene-1,4-benzothiazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[4-(cyanomethyl)-3-oxidanylidene-1,4-benzothiazin-2-yl]ethanoate Openeye Name: ethyl 2-[4-(cyanomethyl)-3-oxo-1,4-benzothiazin-2-yl]acetate CAS Name: 2-[4-(cyanomethyl)-3-oxo-1,4-benzothiazin-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(cyanomethyl)-3-oxo-1,4-benzothiazin-2-yl]acetate Traditional Name: 2-[4-(cyanomethyl)-3-keto-1,4-benzothiazin-2-yl]acetic acid ethyl ester Formula: C14H14N2O3S MolecularWeight: 290.33756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(=O)N(C2=CC=CC=C2S1)CC#N

Isomeric SMILES

CCOC(=O)CC1C(=O)N(C2=CC=CC=C2S1)CC#N

InChI

InChI=1S/C14H14N2O3S/c1-2-19-13(17)9-12-14(18)16(8-7-15)10-5-3-4-6-11(10)20-12/h3-6,12H,2,8-9H2,1H3