6-ethylsulfonyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid

Systemtic Name: 6-ethylsulfonyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid Openeye Name: 6-ethylsulfonyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid CAS Name: 6-ethylsulfonyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid IUPAC Name: 6-ethylsulfonyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid Traditional Name: 6-esyl-4-mesyl-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid Formula: C12H15NO7S2 MolecularWeight: 349.38

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)OC(CN2S(=O)(=O)C)C(=O)O

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)OC(CN2S(=O)(=O)C)C(=O)O

InChI

InChI=1S/C12H15NO7S2/c1-3-22(18,19)8-4-5-10-9(6-8)13(21(2,16)17)7-11(20-10)12(14)15/h4-6,11H,3,7H2,1-2H3,(H,14,15)