2-[(2R)-6-ethylsulfonyl-3-oxidanylidene-4H-1,4-benzoxazin-2-yl]ethanoate

Systemtic Name: 2-[(2R)-6-ethylsulfonyl-3-oxidanylidene-4H-1,4-benzoxazin-2-yl]ethanoate Openeye Name: 2-[(2R)-6-ethylsulfonyl-3-oxo-4H-1,4-benzoxazin-2-yl]acetate CAS Name: 2-[(2R)-6-ethylsulfonyl-3-oxo-4H-1,4-benzoxazin-2-yl]acetate IUPAC Name: 2-[(2R)-6-ethylsulfonyl-3-oxo-4H-1,4-benzoxazin-2-yl]acetate Traditional Name: 2-[(2R)-6-esyl-3-keto-4H-1,4-benzoxazin-2-yl]acetate Formula: C12H12NO6S- MolecularWeight: 298.29178

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)OC(C(=O)N2)CC(=O)[O-]

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)O[C@@H](C(=O)N2)CC(=O)[O-]

InChI

InChI=1S/C12H13NO6S/c1-2-20(17,18)7-3-4-9-8(5-7)13-12(16)10(19-9)6-11(14)15/h3-5,10H,2,6H2,1H3,(H,13,16)(H,14,15)/p-1/t10-/m1/s1