ethyl 4-(5,6-dihydro-1,4,2-oxathiazin-3-yl)benzoate

Systemtic Name: ethyl 4-(5,6-dihydro-1,4,2-oxathiazin-3-yl)benzoate Openeye Name: ethyl 4-(5,6-dihydro-1,4,2-oxathiazin-3-yl)benzoate CAS Name: 4-(5,6-dihydro-1,4,2-oxathiazin-3-yl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(5,6-dihydro-1,4,2-oxathiazin-3-yl)benzoate Traditional Name: 4-(5,6-dihydro-1,4,2-oxathiazin-3-yl)benzoic acid ethyl ester Formula: C12H13NO3S MolecularWeight: 251.30152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=NOCCS2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=NOCCS2

InChI

InChI=1S/C12H13NO3S/c1-2-15-12(14)10-5-3-9(4-6-10)11-13-16-7-8-17-11/h3-6H,2,7-8H2,1H3